SCHEMBL8916709

SCHEMBL8916709

CCc1c(CCN2CCC(c3csc4cc(F)ccc34)CC2)sc2c1CCN(C(C)=O)C2

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSS P25774 4/20 0.49
DRD2 P14416 3/20 0.38
SLC6A4 P31645 3/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
RBP4 P02753 3/20 0.36
MCHR1 Q99705 3/20 0.36
HTR1D P28221 2/20 0.35
HTR1B P28222 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CCR3 P51677 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34

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
Hydrochloric Acid SCHEMBL8920486 0.99 CTSS (0.48) CTSSDRD2SLC6A4TP53GAA
SCHEMBL8916428 0.95 CTSS (0.49) CTSSDRD2SLC6A4TP53GAA
SCHEMBL8915726 0.92 CTSS (0.40) CTSSDRD2SLC6A4TP53MAPT
SCHEMBL8917783 0.91 CTSS (0.50) CTSSDRD2SLC6A4TP53GAA
SCHEMBL8915757 0.90 CTSS (0.51) CTSSDRD2SLC6A4TP53GAA
SCHEMBL8919123 0.87 DRD2 (0.39) CTSSDRD2SLC6A4TP53MAPT
SCHEMBL8916920 0.87 CTSS (0.41) CTSSDRD2TP53GAAMAPT
SCHEMBL8919136 0.86 CTSS (0.40) CTSSTP53GAAMAPTMCHR1
SCHEMBL8916994 0.86 HTR2A (0.43) CTSSDRD2TP53GAAMAPT
SCHEMBL8916426 0.86 MAPT (0.40) CTSSDRD2SLC6A4TP53GAA

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