SCHEMBL5722666

SCHEMBL5722666

COc1cc2c(cc1Br)OCC2

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.50
HTR2A P28223 8/20 0.50
HTR2B P41595 6/20 0.50
ERN1 O75460 1/20 0.40
CYP3A4 P08684 2/20 0.39
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 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

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
SCHEMBL30665872 0.93 HTR2A (0.50) HTR2CHTR2AHTR2BERN1MEN1
SCHEMBL26654718 0.93 HTR2A (0.50) HTR2CHTR2AHTR2BERN1MEN1
SCHEMBL10459592 0.82 HTR2A (0.34) HTR2CHTR2AHTR2BERN1CYP3A4
SCHEMBL38652858 0.81 HTR2A (0.42) HTR2CHTR2AHTR2BCYP3A4MAPT
SCHEMBL27033010 0.81 MEN1 (0.47) HTR2CHTR2AHTR2BMAPTMEN1
SCHEMBL29828820 0.81 MEN1 (0.47) HTR2CHTR2AHTR2BMAPTMEN1
SCHEMBL8637498 0.79 POLB (0.41) HTR2CHTR2AHTR2BERN1CYP3A4
SCHEMBL9086137 0.79 ERN1 (0.46) HTR2AERN1
SCHEMBL1701459 0.78 AHR (0.42) ERN1MAPTNPC1RAB9A
SCHEMBL23363326 0.78 MAOB (0.45) HTR2CHTR2AHTR2BCYP3A4MAPT

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250145637-A1 SULFONAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2025-05-08 US disclosed
EP-4385989-A1 SULFONAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2024-06-19 EP disclosed
CN-117597341-A Sulfonamide derivative, preparation method and application thereof in medicine 江苏恒瑞医药股份有限公司 2024-02-23 CN disclosed
WO-2023016484-A1 SULFONAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 江苏恒瑞医药股份有限公司 2023-02-16 WO disclosed
WO-2023016484-A1 SULFONAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 江苏恒瑞医药股份有限公司 2023-02-16 WO disclosed
EP-0841925-B1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2006-10-04 EP disclosed
US-6482956-B2 FOR THERAPY OF CARDIOVASCULAR, CEREBROVASCULAR, RESPIRATORY AND RENAL DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-11-19 US disclosed
US-20020072614-A1 Endothelin receptor antagonists LUENGO JUAN IGNACIO (US) 2002-06-13 US disclosed
US-6353116-B1 Endothelin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2002-03-05 US disclosed
EP-0841925-A4 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2001-10-17 EP disclosed
US-6096897-A NOVEL 1,2,3-TRIAZOLES SMITHKLINE BEECHAM CORPORATION (US) 2000-08-01 US disclosed
US-5969151-A PYRAZOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1999-10-19 US disclosed
US-5958968-A CARDIOVASCULAR DISORDERS; KIDNEY DIEASES SMITHKLINE BEECHAM CORPORATION (US) 1999-09-28 US disclosed
EP-0841925-A1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1998-05-20 EP disclosed
WO-1997004772-A1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-02-13 WO 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 (2 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-20250145637-A1 SULFONAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF SULT2A1, KAT8, TST HTR2C 4501/4885HTR2A 4514/4885HTR2B 4354/4885
US-20020072614-A1 Endothelin receptor antagonists EDNRA, EDNRB, ECE1 HTR2C 262/4885HTR2A 306/4885HTR2B 213/4885

“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.