SCHEMBL11146311

SCHEMBL11146311

CN1C(=O)CSC1=NC(=O)Nc1c(F)cccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 2/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CYP3A4 P08684 2/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ GAA P10253 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ DGAT1 O75907 2/20 0.36
▸ USP2 O75604 2/20 0.36
▸ TP53 P04637 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL11155555 0.92 GRM5 (0.46) GRM5MEN1KMT2AALDH1A1NPC1
SCHEMBL11155554 0.92 GRM5 (0.46) GRM5MEN1KMT2AALDH1A1NPC1
SCHEMBL11149203 0.92 KMT2A (0.45) GRM5MEN1KMT2AALDH1A1CYP3A4
SCHEMBL11149198 0.92 KMT2A (0.45) GRM5MEN1KMT2AALDH1A1CYP3A4
SCHEMBL11144521 0.87 GRM5 (0.42) GRM5MEN1KMT2AALDH1A1NPC1
SCHEMBL11141779 0.87 GRM5 (0.42) GRM5MEN1KMT2AALDH1A1NPC1
SCHEMBL11148292 0.87 L3MBTL1 (0.41) GRM5MEN1KMT2AALDH1A1NPC1
SCHEMBL11145628 0.86 GRM5 (0.42) GRM5MEN1KMT2AALDH1A1NPC1
SCHEMBL11148694 0.86 L3MBTL1 (0.54) GRM5KMT2AALDH1A1NPC1RAB9A
SCHEMBL11144761 0.84 ALDH1A1 (0.44) GRM5MEN1KMT2AALDH1A1NPC1

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-4402964-A N-Aryl-N'-(3-methyl or ethyl-4-oxothiazolidinylidene)ureas useful for the treatment of epilepsy MCNEILAB, INC. (US) 1983-09-06 — — US disclosed
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