SCHEMBL8916426

SCHEMBL8916426

CCc1c(CCN2CCC(c3cc4ccc(F)cc4s3)CC2)sc2c1CCN(C(C)=O)C2

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
TP53 P04637 2/20 0.40
GAA P10253 1/20 0.40
SLC6A4 P31645 2/20 0.39
DRD2 P14416 1/20 0.39
MCHR1 Q99705 3/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HTR1A P08908 2/20 0.36
RBP4 P02753 2/20 0.35
CCR3 P51677 1/20 0.35
THRB P10828 1/20 0.35
CTSS P25774 1/20 0.35

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
SCHEMBL8916713 0.93 SLC6A4 (0.39) MAPTTP53GAASLC6A4DRD2
SCHEMBL8917705 0.90 DRD2 (0.52) MAPTTP53GAASLC6A4DRD2
SCHEMBL8917865 0.86 MAPT (0.38) MAPTTP53GAADRD2MCHR1
SCHEMBL8916920 0.86 CTSS (0.41) MAPTTP53GAADRD2MCHR1
SCHEMBL8916709 0.86 CTSS (0.49) MAPTTP53GAASLC6A4DRD2
SCHEMBL8919136 0.86 CTSS (0.40) MAPTTP53GAAMCHR1CCR3
SCHEMBL8918401 0.85 HTR1D (0.49) MAPTTP53GAADRD2MCHR1
Hydrochloric Acid SCHEMBL8920486 0.85 CTSS (0.48) MAPTTP53GAASLC6A4DRD2
Oxalic Acid SCHEMBL8991806 0.84 CTSS (0.40) MAPTTP53GAADRD2MCHR1
SCHEMBL8916930 0.83 SLC6A4 (0.52) MAPTTP53GAASLC6A4DRD2

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