SCHEMBL917519

SCHEMBL917519

Cc1cc2cc[nH]c2cc1Br

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.55
AHR P35869 8/20 0.50
CYP2A6 P11509 3/20 0.50
NR4A2 P43354 2/20 0.50
GPR84 Q9NQS5 1/20 0.47
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
CMA1 P23946 1/20 0.41
F7 P08709 1/20 0.41
LTA4H P09960 1/20 0.41
F3 P13726 1/20 0.41
TYR P14679 1/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
ALOX15 P16050 1/20 0.41
RAD51 Q06609 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
IMPDH2 P12268 1/20 0.37

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
SCHEMBL30573025 1.00 CSNK2A1 (0.55) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL849501 0.92 CSNK2A1 (0.60) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL23932310 0.82 CSNK2A1 (0.69) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL827047 0.82 GPR84 (0.54) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL916811 0.79 GPR84 (0.47) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL916587 0.75 GPR84 (0.69) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL1076943 0.75 CSNK2A1 (0.85) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL25594837 0.75 CSNK2A1 (0.55) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL29507011 0.75 GPR84 (0.69) CSNK2A1AHRCYP2A6NR4A2GPR84
SCHEMBL2960506 0.75 CSNK2A1 (0.55) CSNK2A1AHRCYP2A6NR4A2GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3870583-B1 SUBSTITUTED INDOLE AND INDAZOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2026-04-22 EP disclosed
US-20250353830-A1 NOVEL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-11-20 US disclosed
CN-119899150-A Synthetic method and application of 3-trifluoromethyl quinoline compound 遵义医科大学 2025-04-29 CN disclosed
EP-4531858-A1 NOVEL COMPOUNDS F. Hoffmann-La Roche AG (CH) 2025-04-09 EP disclosed
CN-119300833-A Novel compounds 豪夫迈·罗氏有限公司 2025-01-10 CN disclosed
US-12172995-B2 Substituted indole and indazole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-12-24 US disclosed
CN-119019362-A Heteroaromatic ring compound, pharmaceutical composition and application thereof 上海艾力斯医药科技股份有限公司 2024-11-26 CN disclosed
WO-2023232917-A1 NOVEL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-12-07 WO disclosed
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 US disclosed
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 US disclosed
EP-2125749-A2 FUNCTIONALLY SELECTIVE ALPHA2C ADRENORECEPTOR AGONISTS SCHERING CORPORATION (US) 2009-12-02 EP disclosed
WO-2008100456-A2 FUNCTIONALLY SELECTIVE ALPHA2C ADRENORECEPTOR AGONISTS SCHERING CORPORATION (US) 2008-08-21 WO disclosed
WO-2008100456-A2 FUNCTIONALLY SELECTIVE ALPHA2C ADRENORECEPTOR AGONISTS SCHERING CORPORATION (US) 2008-08-21 WO disclosed
US-20070225352-A1 Novel Androgens PHARMACOPELA DRUG DISCOVERY, INC. (US) 2007-09-27 US disclosed
EP-1742912-A1 NOVEL ANDROGENS N.V. Organon (NL) 2007-01-17 EP disclosed
WO-2005102998-A1 NOVEL ANDROGENS N.V. ORGANON (NL) 2005-11-03 WO disclosed
US-5834494-A SEROTONIN 5HT2B/2C RECEPTOR ANTAGONISTS; CNS NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS; IRRITABLE BOWEL SYNDROME SMITHKLINE BEECHAM P.L.C. (GB) 1998-11-10 US disclosed
EP-0707581-B1 INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-02-26 EP disclosed
EP-0707581-A1 INDOLINE DERIVATIVES AS 5HT 2C? ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1996-04-24 EP disclosed
WO-1995001976-A1 INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-01-19 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 (4 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-20070225352-A1 Novel Androgens NR5A1, AR, SHBG CSNK2A1 334/4885AHR 354/4885CYP2A6 154/4885
US-20250353830-A1 NOVEL COMPOUNDS UQCRB, CCNB3, C5 CSNK2A1 2005/4885AHR 1827/4885CYP2A6 682/4885
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN TRPV1, SCN3A, KCNN3 CSNK2A1 778/4885AHR 2604/4885CYP2A6 716/4885
US-12172995-B2 Substituted indole and indazole compounds TLR1, TLR7, IDO1 CSNK2A1 518/4885AHR 95/4885CYP2A6 2201/4885

“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.