SCHEMBL7476441

SCHEMBL7476441

O=C(CN1CCC(c2ccc(Cc3ccc(F)cc3)cc2)CC1)Nc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
DRD4 P21917 7/20 0.61
DRD2 P14416 3/20 0.59
DRD3 P35462 3/20 0.59
REV1 Q9UBZ9 1/20 0.59
HTT P42858 2/20 0.55
CHRNB2 P17787 1/20 0.55
CHRNB4 P30926 1/20 0.55
CHRNA3 P32297 1/20 0.55
CHRNA4 P43681 1/20 0.55
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
THRB P10828 1/20 0.54
RECQL P46063 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL17731134 0.89 DRD4 (0.67) LMNASMN1; SMN2DRD4DRD2DRD3
SCHEMBL8216077 0.82 DRD2 (0.59) LMNADRD2ALDH1A1
SCHEMBL7465842 0.82 DRD4 (0.46) DRD4DRD2DRD3
SCHEMBL8300501 0.81 DRD4 (0.60) LMNASMN1; SMN2DRD4DRD2DRD3
SCHEMBL7476763 0.81 NPC1 (0.54) LMNASMN1; SMN2DRD4DRD2DRD3
SCHEMBL7474955 0.80 ALDH1A1 (0.66) LMNASMN1; SMN2DRD4DRD2DRD3
SCHEMBL8581205 0.79 CCR2 (0.47) DRD2
SCHEMBL17730978 0.77 DRD2 (0.68) LMNASMN1; SMN2DRD4DRD2DRD3
SCHEMBL22791636 0.77 ALDH1A1 (0.48) LMNASMN1; SMN2DRD4REV1HTT
SCHEMBL4003794 0.76 DRD4 (1.00) DRD4

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-0757986-B1 Arylpiperidine and arylpiperazine derivatives and drugs containing the same SUNTORY LTD (JP) 2002-06-12 EP disclosed
US-5723475-A Arylpiperidine and arylpiperazine derivatives and medicament containing the same SUNTORY LIMITED (JP) 1998-03-03 US disclosed
EP-0757986-A1 ARYLPIPERIDINE AND ARYLPIPERAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-12 EP disclosed