SCHEMBL31332750

SCHEMBL31332750

CO[C@](C)(CN)c1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.44
PNMT P11086 2/20 0.40
DPP4 P27487 1/20 0.38
TAAR1 Q96RJ0 3/20 0.38
SCN5A Q14524 3/20 0.38
SCN9A Q15858 3/20 0.38
PKM P14618 1/20 0.37
CYP3A4 P08684 2/20 0.37
IDO1 P14902 2/20 0.37
AGXT P21549 2/20 0.37
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
AOC3 Q16853 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
SCHEMBL31332615 1.00 KIF11 (0.44) KIF11PNMTDPP4TAAR1SCN5A
SCHEMBL31332650 1.00 KIF11 (0.44) KIF11PNMTDPP4TAAR1SCN5A
SCHEMBL14991287 0.78 TAAR1 (0.57) KIF11PNMTDPP4TAAR1SCN5A
SCHEMBL5575375 0.77 KIF11 (0.45) KIF11PNMTTAAR1SCN5ASCN9A
SCHEMBL75674 0.77 KIF11 (0.47) KIF11PNMTTAAR1SCN5ASCN9A
SCHEMBL10918770 0.77 KIF11 (0.40) KIF11PNMTSCN5ASCN9APKM
Hydrochloric Acid SCHEMBL8507689 0.77 TAAR1 (0.55) KIF11PNMTTAAR1SCN5ASCN9A
SCHEMBL31332649 0.73 LOX (0.43)
SCHEMBL14587088 0.71 SCN5A (0.39) KIF11PNMTSCN5ASCN9ACYP3A4
SCHEMBL27278401 0.71 KIF11 (0.39) KIF11PNMTSCN5ASCN9APKM

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-4709708-A1 NOVEL CARBOXAMIDE DERIVATIVES ANGELINI PHARMA S.P.A. (IT) 2026-03-18 EP disclosed
WO-2024233603-A1 NOVEL CARBOXAMIDE DERIVATIVES ICAGEN, LLC (US) 2024-11-14 WO disclosed