SCHEMBL11551809

SCHEMBL11551809

CCCCNS(=O)(=O)c1cc(C(=O)c2c(C)sc3ccccc23)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ CA12 O43570 2/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ FABP4 P15090 1/20 0.41
▸ F10 P00742 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ GAA P10253 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ GCGR P47871 1/20 0.39
▸ POLB P06746 3/20 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
SCHEMBL11556895 0.87 TP53 (0.42) TDP1MEN1TSHRKMT2ATP53
SCHEMBL11554622 0.84 GSTO1 (0.41) TDP1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL11559959 0.81 HSD11B1 (0.43) TP53CA12CA9FABP4F10
SCHEMBL11555852 0.80 MMP2 (0.49) CA12CA9MAPTPOLB
SCHEMBL11595503 0.76 POLB (0.56) TDP1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL11555586 0.76 GAA (0.50) TDP1MEN1TSHRKMT2ATP53
SCHEMBL11560887 0.76 CNR2 (0.53) TDP1MEN1TSHRKMT2ACYP1A2
SCHEMBL11595388 0.75 GSTO1 (0.50) TDP1MEN1TSHRKMT2ATP53
SCHEMBL11527984 0.73 GAA (0.47) TDP1MEN1TSHRKMT2ATP53
SCHEMBL11560954 0.71 CNR2 (0.55) CA12CA9CNR2MAPTPOLB

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-4156732-A Certain pharmaceutical sulfamoylbenzoyl benzofurans, benzothiophenes, and indoles HOECHST AKTIENGESELLSCHAFT (DE) 1979-05-29 — — US disclosed
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