SCHEMBL8916713

SCHEMBL8916713

CCc1c(CCN2CCC(c3cc4ccc(F)cc4s3)CC2)sc2c1CN(C(C)=O)CC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.39
DRD2 P14416 2/20 0.39
MCHR1 Q99705 4/20 0.38
HTR1A P08908 3/20 0.36
CTSS P25774 2/20 0.36
BAZ2B Q9UIF8 1/20 0.35
CCR3 P51677 1/20 0.35
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.35
GAA P10253 1/20 0.35
RBP4 P02753 3/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 2/20 0.33
POLB P06746 1/20 0.33
KCNK3 O14649 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
GMNN O75496 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ADRB2 P07550 1/20 0.33

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
SCHEMBL8916426 0.93 MAPT (0.40) SLC6A4DRD2MCHR1HTR1ACTSS
SCHEMBL8916930 0.90 SLC6A4 (0.52) SLC6A4DRD2MCHR1HTR1ATP53
SCHEMBL8917047 0.86 CTSS (0.42) DRD2MCHR1CTSSBAZ2BCCR3
SCHEMBL8916788 0.86 CTSS (0.42) MCHR1CTSSBAZ2BCCR3HTR1B
Hydrochloric Acid SCHEMBL8917305 0.86 ACHE (0.36) SLC6A4DRD2MCHR1HTR1ACTSS
SCHEMBL8917540 0.85 HTR1D (0.49) SLC6A4DRD2MCHR1HTR1ACTSS
SCHEMBL8917705 0.83 DRD2 (0.52) SLC6A4DRD2MCHR1TP53MAPT
SCHEMBL8916680 0.82 HTR2C (0.52) CYP3A4CYP2D6HTR2AHTR2CHTR7
Hydrochloric Acid SCHEMBL8920342 0.81 CTSS (0.49) SLC6A4DRD2MCHR1CTSSHTR1B
SCHEMBL8917101 0.81 DRD2 (0.54) SLC6A4DRD2HTR2AHTR7DRD3

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
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed