SCHEMBL7464067

SCHEMBL7464067

CN(c1nn(C)c(=O)n(C)c1=O)C1CCC(N2CCN(c3cccc(Cl)c3)CC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAOB P27338 1/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ HTR7 P34969 2/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ HTT P42858 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ REV1 Q9UBZ9 1/20 0.39

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
SCHEMBL7464675 1.00 KMT2A (0.42) KMT2APOLBMAOBADORA2AHTR7
SCHEMBL7472153 1.00 KMT2A (0.42) KMT2APOLBMAOBADORA2AHTR7
SCHEMBL7897452 0.79 POLB (0.45) KMT2APOLBMAOBADORA2AALDH1A1
SCHEMBL7897454 0.79 POLB (0.45) KMT2APOLBMAOBADORA2AALDH1A1
SCHEMBL7902239 0.79 POLB (0.45) KMT2APOLBMAOBADORA2AALDH1A1
SCHEMBL7472167 0.77 POLB (0.45) POLBHTR7ALDH1A1SMN1; SMN2HTT
SCHEMBL7468722 0.77 POLB (0.45) POLBHTR7ALDH1A1SMN1; SMN2HTT
SCHEMBL7464063 0.77 POLB (0.45) POLBHTR7ALDH1A1SMN1; SMN2HTT
SCHEMBL3965782 0.70 POLB (0.67) KMT2APOLBHTR7ALDH1A1SMN1; SMN2
SCHEMBL7464430 0.70 ALDH1A1 (0.55) POLBHTR7ALDH1A1SMN1; SMN2HTT

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-1023273-B1 CYCLOHEXANE DERIVATIVES DIFUNCTIONALISED IN 1,4 AS LIGANDS OF 5HT1A RECEPTORS PF MEDICAMENT (FR) 2002-06-05 — — EP claimed
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