SCHEMBL7464063

SCHEMBL7464063

Cn1nc(NCC2CCC(N3CCN(c4cccc(Cl)c4)CC3)CC2)c(=O)n(C)c1=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.45
▸ HTR1A P08908 1/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ HTR7 P34969 1/20 0.43
▸ HTR6 P50406 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ HTT P42858 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ REV1 Q9UBZ9 1/20 0.41

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
SCHEMBL7472167 1.00 POLB (0.45) POLBHTR1ADRD2HTR2AHTR7
SCHEMBL7468722 1.00 POLB (0.45) POLBHTR1ADRD2HTR2AHTR7
SCHEMBL7897454 0.85 POLB (0.45) POLBHTR1ADRD2HTR2AALDH1A1
SCHEMBL7902239 0.85 POLB (0.45) POLBHTR1ADRD2HTR2AALDH1A1
SCHEMBL7897452 0.85 POLB (0.45) POLBHTR1ADRD2HTR2AALDH1A1
SCHEMBL8797545 0.78 KCNH2 (0.60) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL7472153 0.77 KMT2A (0.42) POLBHTR7ALDH1A1SMN1; SMN2HTT
SCHEMBL7464675 0.77 KMT2A (0.42) POLBHTR7ALDH1A1SMN1; SMN2HTT
SCHEMBL7464067 0.77 KMT2A (0.42) POLBHTR7ALDH1A1SMN1; SMN2HTT
SCHEMBL7464308 0.71 POLB (0.53) POLBHTR1AHTR2AHTR7HTR6

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 3 patents. 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
US-6191130-B1 HYPOTENSIVE AGENTS; THERAPY FOR SEXUAL DISORDERS; CENTRAL NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS PIERRE FABRE MEDICAMENT (FR) 2001-02-20 — — US claimed
US-6191130-B1 HYPOTENSIVE AGENTS; THERAPY FOR SEXUAL DISORDERS; CENTRAL NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS PIERRE FABRE MEDICAMENT (FR) 2001-02-20 — — US disclosed
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