SCHEMBL8210609

SCHEMBL8210609

Cc1ccc(NC(=O)NC2=CC(=O)SC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.50
NPC1 O15118 8/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
MAPT P10636 4/20 0.50
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
TP53 P04637 2/20 0.50
GAA P10253 1/20 0.50
ALOX15 P16050 1/20 0.50
GFER P55789 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.46
PTPN7 P35236 1/20 0.45
PKM P14618 1/20 0.45
ATM Q13315 1/20 0.45
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL7529461 0.85 KMT2A (0.49) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL7518699 0.85 MAOA (0.51) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL7521962 0.85 ALDH1A1 (0.51) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL7524755 0.84 SMN1; SMN2 (0.55) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL7525033 0.81 RAB9A (0.56) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL7517281 0.80 KMT2A (0.62) MAPTKMT2AMEN1PTPN7
SCHEMBL7560746 0.79 KDM4E (0.46) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL7518438 0.78 EPHX1 (0.61) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL7515289 0.76 MAPT (0.45) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL1275920 0.76 ALDH1A1 (0.70) RAB9ANPC1SMN1; SMN2MAPTKMT2A

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-1009747-A1 UREIDO AND THIOUREIDO DERIVATIVES OF 4-AMINO-2(5H)-FURANONES AND 4-AMINO-2(5H)-THIOPHENONES AS ANTITUMOR AGENTS Roche Diagnostics GmbH (DE) 2000-06-21 EP disclosed
WO-1999012917-A1 UREIDO AND THIOUREIDO DERIVATIVES OF 4-AMINO-2(5H)-FURANONES AND 4-AMINO-2(5H)-THIOPHENONES AS ANTITUMOR AGENTS ROCHE DIAGNOSTICS GMBH (DE) 1999-03-18 WO disclosed