SCHEMBL8557341

SCHEMBL8557341

Nc1nc(C2CCN(CCc3ccccc3)CC2)c(-c2ccc(F)cc2)s1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.55
DRD4 P21917 2/20 0.50
DRD3 P35462 2/20 0.50
SSTR5 P35346 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
DRD2 P14416 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL27500235 0.77 CYP1A2 (0.38) PRCPDRD4ALDH1A1CYP1A2CYP3A4
SCHEMBL27500236 0.74 CYP1A2 (0.39) DRD4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL8552184 0.71 DRD4 (0.61) PRCPDRD4DRD3SSTR5ALDH1A1
SCHEMBL14841141 0.71 PRCP (1.00) PRCPDRD4DRD3SSTR5DRD2
SCHEMBL12186033 0.70 PRCP (0.56) PRCPSSTR5
SCHEMBL6039497 0.69 PRCP (0.52) PRCPDRD4DRD3SSTR5CYP1A2
SCHEMBL8606202 0.68 DRD4 (0.86) PRCPDRD4DRD3ALDH1A1CYP1A2
SCHEMBL14686658 0.68 PRCP (0.72) PRCPDRD4DRD3SSTR5DRD2
SCHEMBL7956248 0.67 HTR2A (0.85) PRCPDRD2
SCHEMBL10395954 0.67 DRD2 (0.50) DRD4DRD3DRD2

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-0816362-A1 THIAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO. LTD (JP) 1998-01-07 EP disclosed