SCHEMBL8917672

SCHEMBL8917672

CC(=O)N1CCc2sc(C(=O)CCCCl)cc2C1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.62
HDAC6 Q9UBN7 8/20 0.46
F2 P00734 1/20 0.41
TPSAB1 Q15661 1/20 0.41
TPSD1 Q9BZJ3 1/20 0.41
TPSG1 Q9NRR2 1/20 0.41
NOTUM Q6P988 1/20 0.40
KDM1A O60341 4/20 0.38
HRH3 Q9Y5N1 1/20 0.37
PRMT5 O14744 5/20 0.36
WDR77 Q9BQA1 5/20 0.36

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
SCHEMBL8917878 0.90 MCHR1 (0.62) MCHR1HDAC6NOTUMHRH3
SCHEMBL8917714 0.86 MCHR1 (0.55) MCHR1HDAC6HRH3
SCHEMBL8919325 0.77 HTR1A (0.43) MCHR1HDAC6F2TPSAB1TPSD1
SCHEMBL8916102 0.74 MCHR1 (0.37) MCHR1NOTUM
SCHEMBL9437225 0.74 HDAC6 (0.50) MCHR1HDAC6F2TPSAB1TPSD1
SCHEMBL8917193 0.72 MCHR1 (0.48) MCHR1HDAC6
SCHEMBL21411146 0.72 HDAC6 (0.49) MCHR1HDAC6F2TPSAB1TPSD1
SCHEMBL8915820 0.72 ALDH1A1 (0.46) MCHR1
SCHEMBL4858086 0.71 MCHR1 (0.61) MCHR1NOTUMHRH3PRMT5
SCHEMBL3555661 0.71 NOTUM (0.47) MCHR1HDAC6F2TPSAB1TPSD1

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 3 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
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP disclosed