SCHEMBL35210329

SCHEMBL35210329

COc1ccc2ccn(-c3nc(Cl)ncc3Cl)c2c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 8/20 0.50
ROCK1 Q13464 2/20 0.50
RPS6KA4 O75676 1/20 0.50
MAPT P10636 2/20 0.46
MAOB P27338 1/20 0.40
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
MAPK10 P53779 1/20 0.37
NCOA1 Q15788 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
CA2 P00918 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
SCHEMBL20548870 1.00 RPS6KA5 (0.50) RPS6KA5ROCK1RPS6KA4MAPTMAOB
SCHEMBL30459868 0.84 ROCK1 (0.46) RPS6KA5ROCK1RPS6KA4MAPTMAOB
SCHEMBL20548967 0.77 ROCK1 (0.72) RPS6KA5ROCK1MAPTMAOBHTR2A
SCHEMBL8878531 0.77 KMT2A (0.47) ROCK1MAPTMEN1KMT2AALDH1A1
SCHEMBL19100350 0.76 RPS6KA5 (0.67) RPS6KA5ROCK1RPS6KA4KMT2A
SCHEMBL30556253 0.76 RPS6KA5 (0.67) RPS6KA5ROCK1RPS6KA4KMT2A
SCHEMBL19089678 0.73 RPS6KA5 (0.59) RPS6KA5ROCK1RPS6KA4MAPTHTR2C
SCHEMBL28554877 0.72 ROCK1 (0.57) ROCK1MAPTMAOBHTR2AHTR2C
SCHEMBL28568052 0.72 ROCK1 (0.60) RPS6KA5ROCK1MAPTMAOBHTR2A
SCHEMBL20357808 0.70 RPS6KA5 (0.47) RPS6KA5ROCK1RPS6KA4MAPTKMT2A

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
EP-3398939-B1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY ANCUREALL PHARMACEUTICAL SHANGHAI CO LTD (CN) 2026-05-06 EP disclosed