SCHEMBL8524708

SCHEMBL8524708

CC(=O)c1sc(Cl)nc1C.CC(C)(C)ON=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 5/20 0.42
RAB9A P51151 2/20 0.41
PKM P14618 1/20 0.40
MAPT P10636 2/20 0.39
AHR P35869 1/20 0.39
AMY1A P0DUB6 1/20 0.38
MEN1 O00255 1/20 0.38
DHODH Q02127 1/20 0.37
NPC1 O15118 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 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
SCHEMBL8485222 0.83 CDC7 (0.46) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL8480288 0.82 ALDH1A1 (0.70) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL4762263 0.73 L3MBTL1 (0.33) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL3500221 0.68 ALDH1A1 (0.70) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL2514326 0.68 ALDH1A1 (1.00) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL19067683 0.67 ALDH1A1 (0.63) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL19981322 0.67 HPGD (0.63) ALDH1A1HPGDTSHRL3MBTL1KMT2A
Hydrochloric Acid SCHEMBL8761196 0.67 ALDH1A1 (0.96) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL27259598 0.66 ALDH1A1 (0.50) ALDH1A1HPGDTSHRL3MBTL1KMT2A
SCHEMBL14357152 0.65 CNR1 (0.50) ALDH1A1HPGDTSHRL3MBTL1KMT2A

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
WO-1999018102-A1 FUNGICIDAL AND ARTHROPODICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-04-15 WO disclosed