SCHEMBL6899659

SCHEMBL6899659

c1ccc2nc(Sc3ccc4ccccc4n3)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 5/20 0.53
PRNP P04156 5/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 5/20 0.50
NPSR1 Q6W5P4 4/20 0.50
NCF1 P14598 3/20 0.50
MAPK10 P53779 2/20 0.50
CYP1A2 P05177 2/20 0.50
NOS2 P35228 1/20 0.50
BACE1 P56817 1/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
RAB9A P51151 2/20 0.49
HPGD P15428 3/20 0.47
NPC1 O15118 1/20 0.47
CYP3A4 P08684 1/20 0.47
AR P10275 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL2114821 0.87 HPGD (0.58) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL29980222 0.87 HPGD (0.58) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL2098479 0.85 RXFP1 (0.53) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL9294524 0.83 ALDH1A1 (0.48) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL30326644 0.83 RXFP1 (0.41) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL11462962 0.82 RXFP1 (0.47) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL10411067 0.81 RXFP1 (0.50) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL4370424 0.81 RXFP1 (0.50) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL11326601 0.81 RXFP1 (0.50) RXFP1PRNPKDM4EALDH1A1NPSR1
SCHEMBL2200585 0.81 NCF1 (0.52) RXFP1PRNPKDM4EALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117603272-A Organic luminescent material and preparation method and application thereof 黑龙江大学 2024-02-27 CN disclosed
CN-106009556-A Polyethylene glycol terephthalate plastic film used for heating cable 安徽省宁国天成电工有限公司 2016-10-12 CN disclosed
US-6809106-B1 ANTIPROLIFERATION AGENTS; SUCH AS 4-(2-METHOXYPHENOXY)-ANILINO-3-CHLORO-6,7-DIMETHOXYQUINOLINE ASTRAZENECA AB (SE) 2004-10-26 US disclosed
EP-1178966-B1 QUINOLINE DERIVATIVES AS INHIBITORS OF MEK ENZYMES ASTRAZENECA AB (SE) 2003-10-22 EP disclosed
US-6245746-B1 ADMINISTERING AMIDE MICROBIOCIDE ANTIBIOTIC MICROCIDE PHARMACEUTICALS, INC. 2001-06-12 US disclosed
WO-1999037667-A1 EFFLUX PUMP INHIBITORS MICROCIDE PHARMACEUTICALS, INC. (US) 1999-07-29 WO disclosed
CN-88102436-A The preparation of quinolyl thioether and application thereof 1988-11-09 CN disclosed
CN-88102436-A The preparation of quinolyl thioether and application thereof 1988-11-09 CN disclosed