SCHEMBL10179873

SCHEMBL10179873

COc1ccc(CC(=O)c2ccsc2)c(NC(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.42
KMT2A Q03164 5/20 0.42
MEN1 O00255 2/20 0.42
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
F10 P00742 1/20 0.39
USP2 O75604 1/20 0.39
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
DAO P14920 1/20 0.39
MAPK8 P45983 1/20 0.38
MAPK9 P45984 1/20 0.38
MAPK10 P53779 1/20 0.38
GAA P10253 2/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 2/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL4568025 0.85 KMT2A (0.38) MCHR1KMT2AMEN1POLBL3MBTL1
SCHEMBL10179565 0.84 KMT2A (0.51) KMT2AMEN1POLBL3MBTL1TP53
SCHEMBL9101213 0.82 KMT2A (0.49) MCHR1KMT2AMEN1POLBL3MBTL1
SCHEMBL9105339 0.81 KMT2A (0.45) KMT2AMEN1GAAALDH1A1MAPT
SCHEMBL7978840 0.77 KMT2A (0.49) KMT2AMEN1POLBF10GAA
SCHEMBL8761820 0.77 USP2 (0.38) MCHR1KMT2AMEN1POLBL3MBTL1
SCHEMBL3702448 0.75 MCHR1 (0.36) MCHR1KMT2AMEN1POLBLCK
SCHEMBL4568370 0.74 SMN1; SMN2 (0.38) KMT2AMEN1LCKFYNDAO
SCHEMBL17220696 0.74 POLB (0.47) KMT2APOLBF10GAATP53
SCHEMBL3825545 0.74 IDH2 (0.53)

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
EP-2474530-B1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL (JP) 2014-09-03 EP disclosed
EP-2474530-A1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2012-07-11 EP disclosed