SCHEMBL14950464

SCHEMBL14950464

CSCc1ccc(CS)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 10/20 0.52
MAPT P10636 2/20 0.38
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NOS1 P29475 1/20 0.32

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
SCHEMBL17752772 0.93 IDO1 (0.46) IDO1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL5209430 0.86 MAPT (0.44) IDO1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL21765871 0.78 HRH3 (0.42) IDO1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL17752834 0.78 IDO1 (0.50) IDO1NOS1
SCHEMBL14099205 0.77 FOLH1 (0.42) IDO1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL127369 0.76 IDO1 (0.69) IDO1
SCHEMBL515186 0.76 MAPT (0.56) IDO1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL10299392 0.76 IDO1 (0.52) IDO1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL21134934 0.75 IDO1 (0.48) IDO1NOS1
SCHEMBL7658349 0.74 TRPA1 (0.43) IDO1MAPTNPC1RAB9ASMN1; 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-20130123458-A1 CATALYTIC POLYMERIZATION OF POLYMERS CONTAINING ELECTROPHIIC LINKAGES USING NUCLEOPHILIC REAGENTS THE BOARD OF DIRECTORS OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2013-05-16 US disclosed