SCHEMBL31332716

SCHEMBL31332716

CO[C@@](C)(CNC(=O)CCC(O)C(C)(C)C)c1cccc(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 4/20 0.36
SLC6A2 P23975 2/20 0.35
CHRNA1 P02708 1/20 0.35
CHRNG P07510 1/20 0.35
ITGA5 P08648 1/20 0.35
CHRNB1 P11230 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
SLC6A4 P31645 1/20 0.35
CHRNA3 P32297 1/20 0.35
CYP2C19 P33261 1/20 0.35
HRH1 P35367 1/20 0.35
CHRNA7 P36544 1/20 0.35
OPRK1 P41145 1/20 0.35
CHRNA4 P43681 1/20 0.35
SLC6A3 Q01959 1/20 0.35
CHRND Q07001 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL31332613 0.79 ALDH1A1 (0.46) KMT2AMEN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL31332706 0.75 EPHX2 (0.53) ALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL31332818 0.73 EPHX1 (0.50)
SCHEMBL31332799 0.72 POLB (0.53) KMT2AMEN1ALDH1A1KCNH2SMN1; SMN2
SCHEMBL31332801 0.71 EPHX2 (0.49) KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL31332653 0.71 EPHX2 (0.49) KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL31332776 0.71 ALDH1A1 (0.51) KMT2AMEN1ALDH1A1SMN1; SMN2HPGD
SCHEMBL14992387 0.67 RAB9A (0.46) KMT2AMEN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL31332650 0.66 KIF11 (0.44)
SCHEMBL31332750 0.66 KIF11 (0.44)

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