SCHEMBL27922936

SCHEMBL27922936

CC(=O)NNC(=S)Nc1cccc(C)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 5/20 0.70
▸ HSD17B10 Q99714 1/20 0.67
▸ ALDH1A1 P00352 13/20 0.64
▸ TP53 P04637 2/20 0.64
▸ RAB9A P51151 7/20 0.63
▸ SMN1; SMN2 Q16637 5/20 0.63
▸ MAPT P10636 5/20 0.61
▸ POLB P06746 1/20 0.61
▸ LMNA P02545 5/20 0.60
▸ MEN1 O00255 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ HPGD P15428 2/20 0.59
▸ ALOX12 P18054 3/20 0.57
▸ CYP1A2 P05177 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ NPC1 O15118 4/20 0.56
▸ MAPK1 P28482 1/20 0.56

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
SCHEMBL28635159 0.86 ALDH1A1 (0.64) GAAHSD17B10ALDH1A1TP53RAB9A
SCHEMBL5179768 0.83 MAPT (0.75) GAAALDH1A1RAB9ASMN1; SMN2MAPT
SCHEMBL19277750 0.83 GAA (1.00) GAAALDH1A1SMN1; SMN2MAPTPOLB
SCHEMBL9453941 0.82 MEN1 (0.77) GAAHSD17B10ALDH1A1RAB9ASMN1; SMN2
SCHEMBL30557461 0.82 MEN1 (0.77) GAAHSD17B10ALDH1A1RAB9ASMN1; SMN2
SCHEMBL10189852 0.81 GAA (0.73) GAAHSD17B10ALDH1A1RAB9ASMN1; SMN2
SCHEMBL30703669 0.81 HSD17B10 (1.00) GAAHSD17B10ALDH1A1RAB9ASMN1; SMN2
SCHEMBL12133 0.81 HSD17B10 (1.00) GAAHSD17B10ALDH1A1RAB9ASMN1; SMN2
SCHEMBL28807981 0.80 SMN1; SMN2 (0.66) GAAHSD17B10ALDH1A1TP53SMN1; SMN2
SCHEMBL21973103 0.79 ALDH1A1 (0.65) GAAALDH1A1TP53RAB9ASMN1; 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
CN-103373969-A Phenyl imidazole ring-substituted amide compounds as well as preparation method and application for same SHANGHAI INST ORGANIC CHEM 2013-10-30 — — CN disclosed
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