SCHEMBL7476550

SCHEMBL7476550

O=C(CCCN1CCC(c2ccc(Cc3ccc(F)cc3)cc2)CC1)Nc1ccccc1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.55
CCR3 P51677 4/20 0.51
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
HDAC1 Q13547 1/20 0.49
PRCP P42785 1/20 0.47

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
SCHEMBL7462774 0.87 S1PR1 (0.49) DRD2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL7461499 0.85 CACNA1G (0.57)
SCHEMBL7465032 0.83 S1PR1 (0.48) CYP3A4CYP2D6CYP2C19HDAC1
SCHEMBL7467430 0.81 TSHR (0.53)
SCHEMBL7465897 0.78 DRD2 (0.49) DRD2
SCHEMBL7963986 0.75 DRD2 (0.62) DRD2PRCP
SCHEMBL7474472 0.75 S1PR1 (0.46) DRD2
SCHEMBL6802419 0.74 HTR7 (0.57) DRD2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL7476441 0.74 LMNA (0.64) DRD2
SCHEMBL11200638 0.73 DRD2 (0.69) DRD2CYP2D6

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