SCHEMBL10593107

SCHEMBL10593107

Oc1cccc2c1ccc1[nH]ncc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 4/20 0.47
▸ AXL P30530 2/20 0.47
▸ IDO1 P14902 3/20 0.44
▸ METAP2 P50579 1/20 0.43
▸ CCNA2 P20248 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ CCNA1 P78396 1/20 0.41
▸ CDK4 P11802 1/20 0.39
▸ CCND1 P24385 1/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ ROCK1 Q13464 1/20 0.39
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ CYP1A2 P05177 3/20 0.38
▸ HPGD P15428 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL277055 0.84 NOS1 (0.59) NOS1AXLIDO1METAP2CDK2
Hydrochloric Acid SCHEMBL6647093 0.82 NOS1 (0.57) NOS1AXLIDO1METAP2CDK2
SCHEMBL10596677 0.78 TDP1 (0.48) NOS1AXLIDO1METAP2CCNA2
SCHEMBL10595712 0.78 NOS1 (0.72) NOS1AXLIDO1METAP2CCNA2
SCHEMBL12321248 0.77 NOS1 (0.56) NOS1AXLIDO1METAP2CCNA2
SCHEMBL10593960 0.76 HCAR2 (0.47) NOS1AXLIDO1METAP2CCNA2
SCHEMBL27074503 0.76 HPRT1 (0.54) NOS1AXLIDO1METAP2CDK2
SCHEMBL29450787 0.76 HPRT1 (0.54) NOS1AXLIDO1METAP2CDK2
SCHEMBL16107538 0.74 IDO1 (0.65) IDO1CDK2JAK2CYP1A2HPGD
SCHEMBL10595698 0.74 BRD4 (0.51) NOS1AXLIDO1METAP2ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4871653-A DEVELOPING IN PRESENCE OF MERCAPTO POLYAZAINDENE PROMOTERS AND NUCLEATING QUATERNARY OR HYDRAZIDE-TYPE COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 1989-10-03 — — US disclosed
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