SCHEMBL9876063

SCHEMBL9876063

CCCCCc1cc2cc(C(C)C)cccc-2c1CCCC

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GCGR P47871 9/20 0.37
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
TLR8 Q9NR97 1/20 0.34
BID P55957 3/20 0.34
MCL1 Q07820 3/20 0.34
BCL2L1 Q07817 2/20 0.34
BAK1 Q16611 2/20 0.34
KAT8 Q9H7Z6 2/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
EP300 Q09472 1/20 0.34
KAT2A Q92830 1/20 0.34
KAT2B Q92831 1/20 0.34
KAT5 Q92993 1/20 0.34
SAE1 Q9UBE0 1/20 0.34
PDE9A O76083 1/20 0.33
GPR3 P46089 1/20 0.33

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
SCHEMBL9876406 0.97 GCGR (0.37) GCGRCTSSCTSKBIDMCL1
SCHEMBL9876431 0.97 GCGR (0.37) GCGRCTSSCTSKBIDMCL1
SCHEMBL9876192 0.97 GCGR (0.37) GCGRCTSSCTSKBIDMCL1
SCHEMBL9876214 0.97 GCGR (0.37) GCGRCTSSCTSKBIDMCL1
SCHEMBL9876281 0.93 CTSS (0.40) GCGRCTSSCTSKTLR8PPARG
SCHEMBL9876293 0.81 CTSS (0.41) CTSSCTSKPPARGPPARA
SCHEMBL9874563 0.80 MEN1 (0.40) CTSSCTSKTLR8BIDMCL1
SCHEMBL9876048 0.80 MEN1 (0.40) CTSSCTSKTLR8BIDMCL1
SCHEMBL9876206 0.80 GCGR (0.39) GCGR
SCHEMBL9876409 0.80 MEN1 (0.40) CTSSCTSKTLR8BIDMCL1

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-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed