SCHEMBL844336

SCHEMBL844336

O=C(O)c1cc2cccnc2s1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.53
CYP2A6 P11509 2/20 0.53
CHRNA7 P36544 2/20 0.46
KDM4E B2RXH2 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 2/20 0.45
GLA P06280 1/20 0.45
PKM P14618 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NAMPT P43490 1/20 0.43
LMNA P02545 1/20 0.42
MCL1 Q07820 1/20 0.41
TBXAS1 P24557 1/20 0.41
AKR1B1 P15121 1/20 0.41
GPR35 Q9HC97 2/20 0.41
RPS6KB2 Q9UBS0 1/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL5235524 0.84 CYP2A6 (0.51) CYP2A6CHRNA7KDM4EALDH1A1NAMPT
SCHEMBL15194378 0.84 CYP2A6 (0.51) CYP2A6CHRNA7KDM4EALDH1A1GLA
SCHEMBL1098501 0.83 HPGD (0.54) CYP2A6CHRNA7KDM4EKMT2AALDH1A1
Hydrochloric Acid SCHEMBL27655726 0.83 CYP2A6 (0.50) CYP2A6CHRNA7KDM4EALDH1A1NAMPT
SCHEMBL27613491 0.83 CYP2A6 (0.50) CYP2A6CHRNA7KDM4EALDH1A1NAMPT
SCHEMBL16516803 0.80 CYP2A6 (0.47) CYP2A6CHRNA7KDM4EKMT2AALDH1A1
SCHEMBL4356226 0.80 ALDH1A1 (0.61) CYP2A6CHRNA7KDM4EMEN1KMT2A
SCHEMBL5516018 0.80 MAPT (0.58) CYP2A6CHRNA7KDM4EMEN1KMT2A
SCHEMBL4317987 0.77 CYP2A6 (0.47) CYP2A6CHRNA7NAMPT
SCHEMBL24621241 0.77 MAP2K1 (0.47) CYP2A6CHRNA7MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026043948-A1 PAN EPHB TYROSINE KINASE FORWARD SIGNALING INHIBITORS IN EPHB-ASSOCIATED DISEASES TEXAS TECH UNIVERSITY SYSTEM (US) 2026-02-26 WO disclosed
US-12312337-B2 Compounds and methods for treating cancer ANTIDOTE IP HOLDINGS, LLC (US) 2025-05-27 US disclosed
US-12297209-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2025-05-13 US disclosed
US-12268694-B2 Combination pharmaceutical agents as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2025-04-08 US disclosed
EP-4504723-A1 N-(3-(BENZO[B]THIOPHENE-2-CARBOXAMIDO)-PHENYL)-2,3-DIHYDROBENZO[B][1,4]DIOXINE-6-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS LACTATE/ATP PRODUCTION INHIBITORS FOR THE TREATMENT OF CANCER WMT AG (DE) 2025-02-12 EP disclosed
CN-118974040-A N- (3- (benzo [ B ] thiophen-2-amido) -phenyl) -2, 3-dihydrobenzo [ B ] [1,4] dioxin-6-amide derivatives and related compounds as lactic acid/ATP production inhibitors for the treatment of cancer 威马特股份公司 2024-11-15 CN disclosed
US-20240360155-A1 Benzodiazepine Derivatives as RSV Inhibitors ENANTA PHARM INC (US) 2024-10-31 US disclosed
WO-2024193640-A1 CDK INHIBITOR 上海齐鲁制药研究中心有限公司 2024-09-26 WO disclosed
US-11952389-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2024-04-09 US disclosed
EP-3687543-B1 COMBINATIONS OF PHARMACEUTICAL AGENTS AS RSV INHIBITORS ENANTA PHARM INC (US) 2024-03-20 EP disclosed
EP-1406901-A1 QUINUCLIDINES-SUBSTITUTED-MULTI-CYCLIC-HETEROARYLS FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-04-14 EP disclosed
US-20030153595-A1 Azabicyclic-substituted fused-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-08-14 US disclosed
WO-2003055878-A1 2-HETEROARYLCARBOXYLIC ACID AMIDES BAYER HEALTHCARE AG (DE) 2003-07-10 WO disclosed
WO-2003029252-A1 AZABICYCLIC-SUBSTITUTED FUSED-HETEROARYL COMPOUNDS FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2003-04-10 WO disclosed
US-20030045540-A1 Quinuclidines-substituted-multi-cyclic-heteroaryls for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-03-06 US disclosed
WO-2002100857-A1 QUINUCLIDINES-SUBSTITUTED-MULTI-CYCLIC-HETEROARYLS FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2002-12-19 WO disclosed
CN-1349535-A Bicyclic heteroaromatic compounds useful as LH agonists AKZO NOBEL NV (NL) 2002-05-15 CN disclosed
CN-1300279-A Modulators of protein tyrosine phosphatases NOVO NORDISK AS (DK) 2001-06-20 CN disclosed
CN-1076697-A BIHETEROCYCLIC FUNGICIDAL COMPOUNDS SCHERING AGROCHEMICALS LTD (GB) 1993-09-29 CN disclosed
EP-0046990-A2 2-Halogeno-4-alkyl-4,7-dihydro-7-oxo-thieno(3,2-b)-pyridine-6-carboxylic acids, salts thereof at the carboxyl group, pharmaceutical use thereof, and intermediates thereof KANEBO, LTD. (JP) 1982-03-10 EP 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 (7 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-20030153595-A1 Azabicyclic-substituted fused-heteroaryl compounds for the treatment of disease MALT1, TPMT, ABCB1 BCL2L1 3160/4885CYP2A6 102/4885CHRNA7 1401/4885
US-20240360155-A1 Benzodiazepine Derivatives as RSV Inhibitors GABRA5, GABRA1, GABBR2 BCL2L1 2647/4885CYP2A6 91/4885CHRNA7 147/4885
US-20030045540-A1 Quinuclidines-substituted-multi-cyclic-heteroaryls for the treatment of disease NQO2, SLC10A1, CYP7A1 BCL2L1 3741/4885CYP2A6 139/4885CHRNA7 594/4885
US-11952389-B2 Benzodiazepine derivatives as RSV inhibitors GABRA5, GABRA1, GABBR2 BCL2L1 2647/4885CYP2A6 91/4885CHRNA7 147/4885
US-12297209-B2 Benzodiazepine derivatives as RSV inhibitors GABRA5, GABRA1, GABBR2 BCL2L1 2647/4885CYP2A6 91/4885CHRNA7 147/4885
US-12268694-B2 Combination pharmaceutical agents as RSV inhibitors ACE, ACE2, SPCS3 BCL2L1 4276/4885CYP2A6 3838/4885CHRNA7 4701/4885
US-12312337-B2 Compounds and methods for treating cancer AHR, ARNT, HMOX1 BCL2L1 695/4885CYP2A6 320/4885CHRNA7 3901/4885

“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.