SCHEMBL30711323

SCHEMBL30711323

COC(=O)c1ccc(C2CC(c3cn[nH]c3)CCN2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ GAA P10253 3/20 0.40
▸ HSD17B10 Q99714 3/20 0.40
▸ TSHR P16473 3/20 0.40
▸ HPGD P15428 2/20 0.40
▸ CASP1 P29466 2/20 0.40
▸ CASP7 P55210 2/20 0.40
▸ ATM Q13315 2/20 0.40
▸ HTT P42858 1/20 0.39
▸ GLA P06280 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ KDM1A O60341 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ HSD11B1 P28845 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL30711363 0.87 HSD11B1 (0.38) KDM1AMAOAHSD11B1
SCHEMBL30711242 0.84 KDM4E (0.42) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL29213808 0.83 GRIN2B (0.47) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL25076785 0.83 GRIN2B (0.47) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL25076786 0.83 GRIN2B (0.47) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL31465048 0.82 CHRNB2 (0.47) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL30711227 0.82 CHRNB2 (0.47) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL30711337 0.82 TSHR (0.41) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL31465089 0.80 KDM4E (0.41) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL30711225 0.80 KDM4E (0.41) MEN1KMT2AKDM4EALDH1A1GAA

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-2023246677-A1 INDOLE-PHENYLPIPERIDINE COMPOUND, METHOD FOR PREPARING SAME, AND USE THEREOF 深圳信立泰药业股份有限公司 2023-12-28 — — WO disclosed
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