SCHEMBL12424741

SCHEMBL12424741

Cc1ccc(C2=C3C(=O)NC(c4ccc(C)cc4C)=C3C(=O)N2)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
LMNA P02545 1/20 0.45
CA9 Q16790 2/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA7 P43166 1/20 0.40
PARP10 Q53GL7 2/20 0.40
ROS1 P08922 1/20 0.40
CDK5 Q00535 1/20 0.40
ACVR1 Q04771 1/20 0.40
LRRK2 Q5S007 1/20 0.40
PARP11 Q9NR21 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ELANE P08246 1/20 0.38
ALPL P05186 2/20 0.38
CSNK1G1 Q9HCP0 1/20 0.38
FGFR1 P11362 1/20 0.37

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
SCHEMBL12577526 0.83 GAA (0.41) GAAMAPTLMNACA9CA1
SCHEMBL12424882 0.81 PPOX (0.48) MAPTLMNALRRK2MAOAMAOB
SCHEMBL3671502 0.79 GAA (0.47) GAAMAPTLMNACA9CA1
SCHEMBL12424846 0.79 ACHE (0.46) GAACA9CA1CA2CA4
SCHEMBL9338722 0.79 CDK4 (0.47) MAPTCA9CA1CA2CA4
SCHEMBL12424869 0.78 NISCH (0.41) MAPTLMNACA9CA1CA2
SCHEMBL2301106 0.76 DAO (0.46) PARP10ACVR1LRRK2PARP11MAOA
SCHEMBL24942181 0.75 MAPK14 (0.46) MAOAMAOBPARP1
SCHEMBL18831115 0.72 CSNK1G1 (0.51) GAAMAPTLMNACA9CA1
SCHEMBL12509636 0.72 TDP2 (0.40) MAPTPARP10PARP1MEN1KMT2A

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-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed