SCHEMBL11264145

SCHEMBL11264145

CCCc1ccc2c(c1)C(C)SCCCN2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.37
SIGMAR1 Q99720 4/20 0.34
NISCH Q9Y2I1 1/20 0.33
HTR1D P28221 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
HTR2C P28335 3/20 0.31
HTR2B P41595 3/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP1 P29466 1/20 0.31
HTT P42858 1/20 0.31
CASP7 P55210 1/20 0.31
HSD17B10 Q99714 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
Hydrochloric Acid SCHEMBL11267326 0.99 KIF11 (0.37) KIF11SIGMAR1NISCHHTR1DCNR1
SCHEMBL11277787 0.92 SIGMAR1 (0.39) KIF11SIGMAR1NISCHHTR1DHTR2C
Hydrochloric Acid SCHEMBL11273339 0.91 SIGMAR1 (0.39) KIF11SIGMAR1NISCHHTR1DHTR2C
SCHEMBL11275856 0.89 KIF11 (0.35) KIF11NISCHKDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL11264015 0.87 KIF11 (0.34) KIF11KDM4EALDH1A1LMNATP53
SCHEMBL11275332 0.78 MAPT (0.36) KIF11HTR2CKDM4EALDH1A1GAA
SCHEMBL11260229 0.77 HTR2A (0.39) HTR2CHTR2BKDM4EMAPTALOX15
SCHEMBL11276985 0.77 CA1 (0.34)
SCHEMBL11263563 0.77 HTR2C (0.39) HTR2CALDH1A1MAPTHTR2A
Hydrochloric Acid SCHEMBL11273176 0.77 MAPT (0.35) KIF11HTR2CKDM4EALDH1A1LMNA

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-4328238-A ANTIDEPRESSANTS, ANTISECRETORY, AND ANTIULCER AGENTS SANKYO COMPANY LIMITED (JP) 1982-05-04 US disclosed