SCHEMBL11699518

SCHEMBL11699518

CSC(=O)Nc1ccc(Cc2ccc(NC(=O)SC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SAE1 Q9UBE0 3/20 0.53
▸ UBA2 Q9UBT2 3/20 0.53
▸ TSHR P16473 1/20 0.53
▸ LMNA P02545 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ HPGD P15428 3/20 0.44
▸ CCNC P24863 1/20 0.44
▸ CDK8 P49336 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ GLA P06280 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ THRA P10827 1/20 0.43
▸ SLC1A3 P43003 1/20 0.42
▸ SLC1A2 P43004 1/20 0.42
▸ SLC1A1 P43005 1/20 0.42

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
SCHEMBL15981314 0.93 POLB (0.53) SAE1UBA2TSHRLMNAKMT2A
SCHEMBL15827481 0.85 FAAH (0.42) SAE1UBA2TSHRLMNAKMT2A
SCHEMBL12049311 0.84 PLG (0.49) —
Hydrochloric Acid SCHEMBL4888001 0.82 PLG (0.50) —
SCHEMBL18854171 0.82 L3MBTL1 (0.54) SAE1UBA2TSHRLMNAKMT2A
SCHEMBL15981315 0.82 SAE1 (0.39) SAE1UBA2TSHRLMNAKMT2A
SCHEMBL6564248 0.80 NPC1 (0.56) TSHRKMT2AMEN1POLBHPGD
SCHEMBL274924 0.78 TSHR (0.79) SAE1UBA2TSHRLMNAKMT2A
SCHEMBL821704 0.77 SAE1 (0.65) SAE1UBA2TSHRLMNAKMT2A
SCHEMBL24512443 0.76 PLK1 (0.58) TSHRLMNAKMT2AMEN1POLB

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-20170137560-A1 POLYISOCYANATE MONOMER COMPOSITION FOR OPTICAL MEMBERS, AND OPTICAL MEMBER AND PRODUCTION METHOD THEREFOR HOYA LENS THAILAND LTD. (TH) 2017-05-18 — — US disclosed
US-4020093-A Method for synthesizing thiocarbamic acid esters ANIC S.P.A. (IT) 1977-04-26 — — US disclosed
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