SCHEMBL1105097

SCHEMBL1105097

C(=C/c1cc2c(s1)c(-c1ccccc1)c(-c1ccccc1)c1sccc12)\c1cc2c(s1)c(-c1ccccc1)c(-c1ccccc1)c1sccc12

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADORA1 P30542 1/20 0.33
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
DHODH Q02127 1/20 0.31

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
SCHEMBL1105106 0.73 MAPT (0.32)
SCHEMBL10300214 0.73 PDPK1 (0.40) ALOX5ADORA3ADORA1CDK4CCND1
SCHEMBL15087958 0.71 ALOX5 (0.32) ALOX5
SCHEMBL20240244 0.70 ALOX5 (0.34) ALOX5ADORA3ADORA1
SCHEMBL14902907 0.70 ALDH1A1 (0.34) ALOX5ADORA3ADORA1DHODH
SCHEMBL3374513 0.69 PDPK1 (0.40) ALOX5ADORA3ADORA1CDK4CCND1
SCHEMBL27986118 0.69 PDE4A (0.36) ALOX5ADORA3ADORA1CDK4CCND1
SCHEMBL12424978 0.67 ESR1 (0.35) ALOX5ADORA3ADORA1CDK4CCND1
SCHEMBL27900555 0.67 MAPT (0.40) ALOX5CDK4CCND1
SCHEMBL14902909 0.67 PLK4 (0.43) ALOX5DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8154014-B2 Organic thin film transistor and organic thin film light-emitting transistor IDEMITSU KOSAN, CO., LTD. (JP) 2012-04-10 US disclosed
US-8154014-B2 Organic thin film transistor and organic thin film light-emitting transistor IDEMITSU KOSAN, CO., LTD. (JP) 2012-04-10 US disclosed
US-20100244000-A1 ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM LIGHT-EMITTING TRANSISTOR IDEMITSU KOSAN CO., LTD. (JP) 2010-09-30 US disclosed
US-20100244000-A1 ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM LIGHT-EMITTING TRANSISTOR IDEMITSU KOSAN CO., LTD. (JP) 2010-09-30 US disclosed