SCHEMBL1346989

SCHEMBL1346989

COc1cc(Br)cc(CBr)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
MAOB P27338 2/20 0.40
CYP19A1 P11511 1/20 0.37
CALM1 P0DP23 5/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
CNR2 P34972 2/20 0.35
GPR55 Q9Y2T6 1/20 0.35
AKR1B1 P15121 1/20 0.35
ERN1 O75460 1/20 0.35
CNR1 P21554 1/20 0.35
IDO1 P14902 1/20 0.34
MEN1 O00255 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29774677 1.00 ALDH1A1 (0.42) ALDH1A1MAOBCYP19A1CALM1TSHR
SCHEMBL6726921 0.91 TACR1 (0.36) ALDH1A1MAOBCYP19A1CALM1TSHR
SCHEMBL1742765 0.86 ALDH1A1 (0.50) ALDH1A1CYP19A1CALM1TSHRMAPK1
SCHEMBL627823 0.86 ALDH1A1 (0.58) ALDH1A1CYP19A1CALM1TSHRMAPK1
SCHEMBL467237 0.84 ALDH1A1 (0.55) ALDH1A1CYP19A1CALM1TSHRMAPK1
SCHEMBL12044476 0.83 PTGS2 (0.43) ALDH1A1MAOBCYP19A1CALM1TSHR
SCHEMBL28764954 0.81 ALDH1A1 (0.40) ALDH1A1MAOBCYP19A1CALM1TSHR
SCHEMBL7672491 0.81 ALDH1A1 (0.40) ALDH1A1MAOBCYP19A1CALM1MAPK1
SCHEMBL1362261 0.81 MAOB (0.42) ALDH1A1MAOBCYP19A1GRIN2DGRIN3B
SCHEMBL587024 0.81 DAO (0.43) ALDH1A1MAOBCYP19A1CALM1TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 87 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4565562-B1 PYRROLIDINE-2-CARBOXAMIDE DERIVATIVES AS PROSTAGLANDIN E2 RECEPTOR 4 (EP4) AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL AND PULMONARY DISEASES NXERA PHARMA UK LTD (GB) 2026-05-27 EP disclosed
US-20260042745-A1 PYRROLIDINE-2-CARBOXAMIDE DERIVATIVES AS PROSTAGLANDIN E2 RECEPTOR 4 (EP4) AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL AND PULMONARY DISEASES NXERA PHARMA UK LIMITED (GB) 2026-02-12 US disclosed
US-12492174-B2 Morpholine-3-carboxamide derivatives as prostaglandin E2 receptor 4 (EP4) agonists for the treatment of gastrointestinal and pulmonary diseases NXERA PHARMA UK LIMITED (GB) 2025-12-09 US disclosed
EP-4651955-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2025-11-26 EP disclosed
US-12404276-B2 Substituted pyrrolo[3,4-c]pyrazoles for treating gastric acid-related diseases SHANGHAI MEDICILON INC. (CN) 2025-09-02 US disclosed
EP-4565562-A1 PYRROLIDINE-2-CARBOXAMIDE DERIVATIVES AS PROSTAGLANDIN E2 RECEPTOR 4 (EP4) AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL AND PULMONARY DISEASES Nxera Pharma UK Limited (GB) 2025-06-11 EP disclosed
US-20250179055-A1 Substituted 2-(pyrrolidine-3-yl)acetic acid derivative, preparation method and use thereof INNOVSTONE THERAPEUTICS LIMITED (CN) 2025-06-05 US disclosed
US-20250179036-A1 MORPHOLINE-3-CARBOXAMIDE DERIVATIVES AS PROSTAGLANDIN E2 RECEPTOR 4 (EP4) AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL AND PULMONARY DISEASES NXERA PHARMA UK LIMITED (GB) 2025-06-05 US disclosed
WO-2025103442-A1 SUBSTITUTED 2-(PYRROLIDIN-3-YL)ACETIC ACID DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翊石医药科技有限公司 2025-05-22 WO disclosed
US-20250136558-A1 PYRAZINE COMPOUNDS AS IRREVERSIBLE INHIBITORS OF FLT3 BIOMEA FUSION, INC. 2025-05-01 US disclosed
US-20050261308-A1 Quinolinone derivatives and uses thereof ROCHE PALO ALTO LLC 2005-11-24 US disclosed
US-6943169-B2 Quinolinone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2005-09-13 US disclosed
WO-2004080969-A1 QUINOLINONE / BENZOXAZINONE DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2004-09-23 WO disclosed
US-20040186092-A1 Quinolinone derivaties and uses thereof ROCHE PALO ALTO LLC 2004-09-23 US disclosed
WO-2004063156-A1 NOVEL INDOLE DERIVATES AS FABP-4 INHIBITORS BIOVITRUM AB (SE) 2004-07-29 WO disclosed
EP-0229510-B1 SULFINYL AND SULFONYL SUBSTITUTED-3-BENZAZEPINES SMITHKLINE BEECHAM CORPORATION (US) 1990-06-06 EP disclosed
US-4824839-A Sulfinyl and sulfonyl substituted 2,3,4,5 tetrahydro-1H-3-benzazepines and their use in treating gastrointestinal motility disorders SMITHKLINE BECKMAN CORPORATION (US) 1989-04-25 US disclosed
EP-0229510-A1 Sulfinyl and sulfonyl substituted-3-benzazepines SMITHKLINE BEECHAM CORPORATION (US) 1987-07-22 EP disclosed
CN-86108627-A The 3-benzazepines that sulfinyl and sulphonyl replace 1987-07-22 CN disclosed
US-4659706-A Sulfinyl and sulfonyl substituted 3-benzazepines SMITHKLINE BECKMAN CORPORATION (US) 1987-04-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250136558-A1 PYRAZINE COMPOUNDS AS IRREVERSIBLE INHIBITORS OF FLT3 FLT3, MCL1, JAK2 ALDH1A1 1930/4885MAOB 3200/4885CYP19A1 3130/4885
US-20040186092-A1 Quinolinone derivaties and uses thereof NQO2, UGT1A8, UGT1A1 ALDH1A1 249/4885MAOB 488/4885CYP19A1 82/4885
US-20260042745-A1 PYRROLIDINE-2-CARBOXAMIDE DERIVATIVES AS PROSTAGLANDIN E2 RECEPTOR 4 (EP4) AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL AND PULMONARY DISEASES PTGER4, PTGER1, PTGER2 ALDH1A1 1803/4885MAOB 2000/4885CYP19A1 4131/4885
US-12492174-B2 Morpholine-3-carboxamide derivatives as prostaglandin E2 receptor 4 (EP4) agonists for the treatment of gastrointestinal and pulmonary diseases PTGER4, PTGER1, PTGER2 ALDH1A1 1720/4885MAOB 1638/4885CYP19A1 1589/4885
US-12404276-B2 Substituted pyrrolo[3,4-c]pyrazoles for treating gastric acid-related diseases GIPR, PGC, GRPR ALDH1A1 625/4885MAOB 2728/4885CYP19A1 2252/4885
US-20250179055-A1 Substituted 2-(pyrrolidine-3-yl)acetic acid derivative, preparation method and use thereof PCSK9, LPL, LYPLA1 ALDH1A1 219/4885MAOB 470/4885CYP19A1 691/4885
US-20050261308-A1 Quinolinone derivatives and uses thereof RECQL, NQO2, QRFPR ALDH1A1 803/4885MAOB 578/4885CYP19A1 133/4885
US-20250179036-A1 MORPHOLINE-3-CARBOXAMIDE DERIVATIVES AS PROSTAGLANDIN E2 RECEPTOR 4 (EP4) AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL AND PULMONARY DISEASES PTGER4, PTGER1, PTGER2 ALDH1A1 1720/4885MAOB 1638/4885CYP19A1 1589/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.