SCHEMBL13618630

SCHEMBL13618630

CCc1ccc(NC(=O)OCCCCOC(=O)Nc2ccc(Cc3ccc(C)cc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.53
NPC1 O15118 8/20 0.53
CASP1 P29466 1/20 0.53
TSHR P16473 1/20 0.51
SMN1; SMN2 Q16637 10/20 0.50
HPGD P15428 4/20 0.50
ALDH1A1 P00352 4/20 0.50
MAPK1 P28482 2/20 0.50
MAPT P10636 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MCL1 Q07820 1/20 0.50
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
ATM Q13315 1/20 0.49
RECQL P46063 2/20 0.48
LMNA P02545 2/20 0.48
HSD17B10 Q99714 1/20 0.48
PKM P14618 1/20 0.47
CYP1A2 P05177 2/20 0.47

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
SCHEMBL13411435 0.94 NPC1 (0.51) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL13695374 0.94 NPC1 (0.51) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL16556379 0.92 TSHR (0.57) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL13931804 0.90 TSHR (0.56) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL13931799 0.90 TSHR (0.56) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL13931805 0.90 TSHR (0.56) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL13004150 0.90 SMN1; SMN2 (0.62) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL14001770 0.90 PKM (0.48) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL19342730 0.88 TDP1 (0.54) RAB9ANPC1CASP1TSHRSMN1; SMN2
SCHEMBL19011398 0.87 SMN1; SMN2 (0.58) RAB9ANPC1CASP1TSHRSMN1; SMN2

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-20090279925-A1 BELT FOR IMAGE FORMING APPARATUS NITTA CORPORATION (JP) 2009-11-12 US disclosed