SCHEMBL16435784

SCHEMBL16435784

CC(C)(C)C1=CC(=c2ccc(=C3C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C3)o2)C=C(C(C)(C)C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
ATM Q13315 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
CES2 O00748 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
CES1 P23141 1/20 0.41
MPI P34949 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MCL1 Q07820 1/20 0.39
NPC1 O15118 1/20 0.35
KMT2A Q03164 1/20 0.35
GPR35 Q9HC97 1/20 0.35
POLB P06746 1/20 0.34
GPR55 Q9Y2T6 1/20 0.34

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
SCHEMBL359232 0.79 ATM (0.52) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL14081321 0.75 ATM (0.48) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL13760887 0.73 ATM (0.39) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL16435779 0.71 ATM (0.41) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL442633 0.70 ATM (0.43) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL16435781 0.69 ATM (0.39) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL20225513 0.69 SMN1; SMN2 (0.44) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL15937720 0.69 SMN1; SMN2 (0.44) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL853674 0.69 MAPT (0.52) SMN1; SMN2ATMALDH1A1MAPTCES2
SCHEMBL12852127 0.68 ATM (0.42) SMN1; SMN2ATMALDH1A1MAPTCES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150037069-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER AND IMAGE FORMING APPARATUS KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2015-02-05 US disclosed
US-20150037069-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER AND IMAGE FORMING APPARATUS KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2015-02-05 US disclosed