SCHEMBL6684432

SCHEMBL6684432

CC1(c2ccccc2)C(=O)CCCC1(N)N

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.39
MEN1 O00255 1/20 0.39
CYP2C9 P11712 1/20 0.39
KMT2A Q03164 1/20 0.39
PNMT P11086 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL512374 0.74 MEN1 (0.44) MEN1CYP2C9KMT2AALDH1A1
SCHEMBL4447105 0.71 MEN1 (0.41) MEN1CYP2C9KMT2AALDH1A1
SCHEMBL3666780 0.70 MEN1 (0.47) MEN1CYP2C9KMT2AALDH1A1
SCHEMBL963045 0.69 MEN1 (0.42) MEN1CYP2C9KMT2AALDH1A1
SCHEMBL23579515 0.69 MEN1 (0.42) MEN1CYP2C9KMT2APNMT
SCHEMBL23579161 0.69 MEN1 (0.42) MEN1CYP2C9KMT2APNMT
SCHEMBL11716598 0.69 MEN1 (0.42) MEN1CYP2C9KMT2APNMT
SCHEMBL6688090 0.68 DPP4 (0.44) PNMT
Hydrochloric Acid SCHEMBL23579257 0.68 MEN1 (0.41) MEN1CYP2C9KMT2A
SCHEMBL7308988 0.67 CYP2C9 (0.44) MEN1CYP2C9KMT2AALDH1A1

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-1246791-B1 AMINOMETHYL-PHENYL-CYCLOHEXANONE DERIVATIVES GRUENENTHAL GMBH (DE) 2004-10-27 EP claimed