SCHEMBL1247086

SCHEMBL1247086

Cc1ccc2cc(Br)ccc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.68
CYP1A2 P05177 4/20 0.68
TDP1 Q9NUW8 1/20 0.56
ALDH1A1 P00352 5/20 0.52
KDM4E B2RXH2 2/20 0.52
MEN1 O00255 1/20 0.52
MAPT P10636 1/20 0.52
KMT2A Q03164 1/20 0.52
MAPK1 P28482 1/20 0.50
MAOB P27338 2/20 0.46
NCEH1 Q6PIU2 1/20 0.41
BACE1 P56817 2/20 0.40
NCK1 P16333 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PTPN1 P18031 1/20 0.40
CA12 O43570 2/20 0.39
CA9 Q16790 2/20 0.39

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
SCHEMBL4585180 0.95 CYP2A6 (0.62) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL13152961 0.95 CYP2A6 (0.62) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL4322069 0.92 CYP2A6 (0.70) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL19660697 0.91 CYP2A6 (0.56) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL25625349 0.88 CYP2A6 (0.52) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL29353067 0.83 CYP2A6 (0.77) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL29389285 0.83 CYP1A2 (1.00) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL192166 0.83 CYP2A6 (0.77) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL308248 0.83 CYP1A2 (1.00) CYP2A6CYP1A2TDP1ALDH1A1KDM4E
SCHEMBL18891725 0.81 CYP2A6 (0.56) CYP2A6CYP1A2TDP1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10195018-A None JP disclosed
WO-2024257966-A1 HIGH-REFRACTIVE-INDEX ORGANIC MATERIAL AND LIGHT-EMITTING DEVICE COMPRISING SAME 비피시 주식회사 2024-12-19 WO disclosed
US-20230158155-A1 Cell Surface Receptor Binding Compounds and Conjugates LYCIA THERAPEUTICS, INC. 2023-05-25 US disclosed
CN-110571340-B Organic electroluminescent device and electronic apparatus 陕西莱特光电材料股份有限公司 2020-11-20 CN disclosed
CN-110534658-B Organic electroluminescent device and electronic apparatus 陕西莱特光电材料股份有限公司 2020-10-30 CN disclosed
EP-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed
WO-2020063760-A1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2020-04-02 WO disclosed
CN-110571340-A Organic electroluminescent device and electronic apparatus 陕西莱特光电材料股份有限公司 2019-12-13 CN disclosed
WO-2019196714-A1 N-SUBSTITUTED ACRYLAMIDE DERIVATIVE AS DHODH INHIBITOR, AND PREPARATION AND USE THEREOF 华东理工大学 2019-10-17 WO disclosed
EP-3242872-B1 (PIPERIDIN-3-YL)(NAPHTHALEN-2-YL)METHANONE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE HISTONE DEMETHYLASE KDM2B FOR THE TREATMENT OF CANCER GENENTECH INC (US) 2019-07-03 EP disclosed
WO-2004041776-A2 SULFONYLAMINOVALEROLAC TAMS AND DERIVATIVES THEREOF AS FACTOR Xa INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-05-21 WO disclosed
JP-2004091428-A METHOD FOR PRODUCING 6-BROMO-2-NAPHTHALENECARBOXYLIC ACID SUMIKIN AIR WATER CHEMICAL INC 2004-03-25 JP disclosed
JP-2004083455-A METHOD FOR MANUFACTURING 6-BROMO-2-METHYLNAPHTHALENE SUMIKIN AIR WATER CHEMICAL INC 2004-03-18 JP disclosed
US-5955487-A TREATING HIGH BLOOD PRESSURE, CARDIAC INSUFFICIENCY, GLAUCOMA CIBA-GEIGY CORPORATION (US) 1999-09-21 US disclosed
JP-H10195018-A PRODUCTION OF METHYL 6-BROMO-2-NAPHTHALENECARBOXYLATE SUMIKIN CHEM CO LTD 1998-07-28 JP disclosed
EP-0528762-B1 N-acyl-N-heterocyclyl- or naphthyl-alkyl amino acids as angiotensin II antagonists CIBA GEIGY AG (CH) 1997-05-07 EP disclosed
US-5620998-A CARDIOVASCULAR DISORDERS; HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-04-15 US disclosed
US-5506240-A HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1996-04-09 US disclosed
EP-0528762-A1 N-acyl-N-heterocyclyl- or naphthyl-alkyl amino acids as angiotensin II antagonists CIBA-GEIGY AG (CH) 1993-02-24 EP disclosed
US-4581380-A TREATMENT OF SKIN DISORDERS;ANTIINFLAMMATORY AGENTS Groupement Economique dite: Centre National de Recherches Dermatologiques C.I.R.D. (FR) 1986-04-08 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 (1 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-20230158155-A1 Cell Surface Receptor Binding Compounds and Conjugates M6PR, ASGR1, IGF2R CYP2A6 2567/4885CYP1A2 4624/4885TDP1 3842/4885

“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.