SCHEMBL8518342

SCHEMBL8518342

Cc1ccc(C(=S)c2c(C)cc(CNS(=O)(=O)Cc3cccnc3)n2C)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
ALDH1A1 P00352 3/20 0.42
KCNJ1 P48048 1/20 0.42
POLB P06746 1/20 0.40
MMP13 P45452 1/20 0.39
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NAMPT P43490 4/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL8518661 0.88 POLB (0.38) ALDH1A1POLBMMP13LMNASMN1; SMN2
SCHEMBL8518959 0.86 NAMPT (0.46) TSHRALDH1A1KCNJ1POLBLMNA
SCHEMBL8519895 0.82 ABCB11 (0.51) TSHRALDH1A1POLBLMNASMN1; SMN2
SCHEMBL8518478 0.82 MEN1 (0.43) TSHRALDH1A1POLBNAMPTHTT
Hydrochloric Acid SCHEMBL8518624 0.82 VNN1 (0.43) TSHRPOLBNAMPTHPGDHTT
Hydrochloric Acid SCHEMBL8519131 0.81 ABCB11 (0.50) TSHRALDH1A1POLBLMNASMN1; SMN2
SCHEMBL8519457 0.80 GAA (0.48) TSHRALDH1A1MMP13SMN1; SMN2NAMPT
SCHEMBL8519780 0.80 LMNA (0.41) TSHRALDH1A1LMNASMN1; SMN2NAMPT
SCHEMBL8518393 0.77 PTGS2 (0.47) TSHRALDH1A1POLBMMP13LMNA
SCHEMBL8519831 0.76 KCNJ1 (0.33) TSHRALDH1A1KCNJ1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952368-A AN INHIBITORS OF PROSTAGLANDIN G/H SYNTHASE, ANTIINFLAMMATORY AND ANALGESIC AGENTS SYNTEX (U.S.A.) INC. (US) 1999-09-14 US disclosed