SCHEMBL161703

SCHEMBL161703

Cc1ccc2nc(C)ccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 1.00
LMNA P02545 2/20 0.63
NCK1 P16333 1/20 0.63
BACE1 P56817 1/20 0.63
KDM4E B2RXH2 1/20 0.63
POLB P06746 1/20 0.63
CASP6 P55212 1/20 0.63
CYP2A6 P11509 3/20 0.55
ALDH1A1 P00352 1/20 0.52
NQO2 P16083 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM1A O60341 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PSMB5 P28074 1/20 0.44
RAB9A P51151 2/20 0.44
CCR1 P32246 1/20 0.44
CCR5 P51681 1/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL29444268 1.00 CYP1A2 (1.00) CYP1A2LMNANCK1BACE1KDM4E
Iodide SCHEMBL31142554 0.98 CYP1A2 (0.95) CYP1A2LMNANCK1BACE1KDM4E
SCHEMBL951793 0.83 CYP1A2 (1.00) CYP1A2LMNAKDM4EPOLBCASP6
SCHEMBL30081469 0.83 CYP1A2 (1.00) CYP1A2LMNAKDM4EPOLBCASP6
SCHEMBL31261751 0.83 CYP1A2 (1.00) CYP1A2LMNAKDM4EPOLBCASP6
SCHEMBL15037486 0.83 CYP1A2 (0.70) CYP1A2LMNANCK1BACE1KDM4E
SCHEMBL9102522 0.82 CYP1A2 (0.68) CYP1A2LMNANCK1BACE1KDM4E
Quinoline SCHEMBL28121629 0.81 ALDH1A1 (0.72) CYP1A2LMNANCK1BACE1KDM4E
SCHEMBL23247265 0.81 CYP1A2 (0.68) CYP1A2LMNANCK1BACE1KDM4E
SCHEMBL15831556 0.80 CYP1A2 (0.65) CYP1A2LMNANCK1BACE1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113176253-B Occult blood indicator for animal excrement and application thereof 上海麦可信生物科技有限公司 2023-05-23 CN claimed
CN-113754583-A 2- ([2, 2' -biquinolyl ] -3-ether) -1-ethanol and derivative and synthetic method thereof 湖南工程学院 2021-12-07 CN claimed
CN-110606839-B Green synthesis method of polysubstituted quinazoline derivative 南方医科大学 2021-10-08 CN claimed
CN-113176253-A Animal excrement occult blood indicator and application thereof 上海麦可信生物科技有限公司 2021-07-27 CN claimed
CN-112979619-A Method for catalyzing dehydrogenation coupling reaction of nitrogen heteroaromatic ring compound and cyclic ether by using Bronsted acid 青岛职业技术学院 2021-06-18 CN claimed
CN-109776406-B Method for cross coupling of ether compound and quinoline derivative 湘潭大学 2021-05-04 CN claimed
CN-108473396-A The method of production and purifying 2,3,3,3- tetrafluoro-1-propenes 阿科玛法国公司 2018-08-31 CN claimed
CN-107835680-A The novel beta hydroxysteroid dehydrogenase of 1 type of selectivity 11 帝斯曼知识产权资产管理有限公司 2018-03-23 CN claimed
CN-106189235-B A kind of sulfone polymer composition and the thermoplastic composition being made from it and application 金发科技股份有限公司 2017-10-24 CN claimed
CN-106565600-A Deuterated aza aromatic compound and synthesis method thereof 湖南大学 2017-04-19 CN claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
US-5657064-A Recording sheets containing pyrrole, pyrrolidine, pyridine, piperidine, homopiperidine, quinoline, isoquinoline, quinuclidine, indole, and indazole compounds XEROX CORPORATION (US) 1997-08-12 US claimed
EP-0743574-A2 Migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
EP-0743573-A2 Method for obtaining image contrast migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
US-5563014-A SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT XEROX CORPORATION (US) 1996-10-08 US claimed
US-5514505-A SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE XEROX CORPORATION (US) 1996-05-07 US claimed
EP-0673782-A2 Recording sheets containing pyrrole, pyrrolidine, pyridine, piperidine, homopiperidine, quinoline, isoquinoline, quinuclidine, indole, and indazole compounds XEROX CORPORATION (US) 1995-09-27 EP claimed
US-4871848-A OIL, GAS WELLS CORROSION INHIBITORS THE DOW CHEMICAL COMPANY (US) 1989-10-03 US claimed
US-4740320-A REACTION OF NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPONENT, KETONE OR ALDEHYDE, AMINE OR POLYAMINE THE DOW CHEMICAL COMPANY (US) 1988-04-26 US claimed
US-3986833-A TEST COMPOSITION, DEVICE, AND METHOD FOR THE DETECTION OF PEROXIDATIVELY ACTIVE SUBSTANCES MILES LABORATORIES, INC. (US) 1976-10-19 US claimed