SCHEMBL11308376

SCHEMBL11308376

O=c1sc2ccc(Cl)cc2n1CC(=S)N1CCN(CCO)CC1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TMEM97 Q5BJF2 3/20 0.57
▸ NPY5R Q15761 11/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ DRD2 P14416 1/20 0.43
▸ DRD4 P21917 1/20 0.43
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ UTS2R Q9UKP6 1/20 0.42
▸ HTR1A P08908 2/20 0.42
▸ HTR7 P34969 2/20 0.42
▸ MAPT P10636 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ DUSP3 P51452 1/20 0.41
▸ PTPN5 P54829 1/20 0.41
▸ PTPN11 Q06124 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
Tiaramide SCHEMBL25172 0.88 NPY5R (0.58) TMEM97NPY5RTSHR
Tiaramide SCHEMBL29376518 0.88 NPY5R (0.58) TMEM97NPY5RTSHR
Tiaramide SCHEMBL181916 0.87 NPY5R (0.58) TMEM97NPY5RTSHR
Tiaramide SCHEMBL29379184 0.87 NPY5R (0.58) TMEM97NPY5RTSHR
SCHEMBL27603207 0.79 TMEM97 (0.51) TMEM97NPY5RALDH1A1HPGDHSD17B10
SCHEMBL13696444 0.78 NPY5R (0.61) TMEM97NPY5RTSHR
SCHEMBL11406400 0.78 NPY5R (0.47) TMEM97NPY5RALDH1A1HPGDHSD17B10
SCHEMBL8894950 0.77 TMEM97 (0.58) TMEM97NPY5RCYP3A4CYP2D6OPRK1
SCHEMBL11343567 0.77 TMEM97 (0.56) TMEM97NPY5RCYP3A4CYP2D6OPRK1
SCHEMBL11440143 0.76 TMEM97 (0.47) TMEM97NPY5RMAPTTSHRMAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56015276-A — — None — — JP disclosed
JP-S5615276-A PIPERAZINE DERIVATIVE OR ITS SALT, AND ITS PREPARATION FUJISAWA PHARMACEUT CO LTD 1981-02-14 — — JP disclosed
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