SCHEMBL11435445

SCHEMBL11435445

Cc1ccc(N)c(C(=O)Nc2ccc3c(O)c(S(=O)(=O)O)ccc3c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLG P00747 5/20 0.47
▸ KLK1 P06870 5/20 0.47
▸ ENPP2 Q13822 7/20 0.42
▸ CASP6 P55212 1/20 0.42
▸ CTDSP1 Q9GZU7 1/20 0.42
▸ PLAU P00749 2/20 0.41
▸ NT5E P21589 1/20 0.40
▸ FADS1 O60427 1/20 0.40
▸ KLK6 Q92876 4/20 0.40
▸ F2 P00734 1/20 0.40
▸ F10 P00742 1/20 0.40
▸ PLAT P00750 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ PRMT3 O60678 1/20 0.38
▸ EP300 Q09472 1/20 0.38
▸ PRMT6 Q96LA8 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
SCHEMBL11427837 0.91 PLG (0.49) PLGKLK1ENPP2CASP6CTDSP1
SCHEMBL11428140 0.85 PLAU (0.46) PLGKLK1CASP6CTDSP1PLAU
SCHEMBL11438365 0.85 TNF (0.45) PLGKLK1ENPP2MEN1KMT2A
SCHEMBL11440412 0.84 ENPP2 (0.43) PLGKLK1ENPP2CASP6CTDSP1
SCHEMBL11427501 0.84 NPC1 (0.45) PLGKLK1ENPP2CASP6CTDSP1
SCHEMBL11204762 0.83 NT5E (0.62) PLGKLK1ENPP2CASP6CTDSP1
SCHEMBL11433703 0.83 TNF (0.48) PLGKLK1ENPP2MEN1KMT2A
SCHEMBL11433818 0.82 PTGES (0.41) PLGKLK1ENPP2PLAUNT5E
SCHEMBL11435442 0.82 CASP6 (0.49) ENPP2CASP6CTDSP1NT5EMEN1
SCHEMBL11440916 0.82 CASP6 (0.64) PLGKLK1ENPP2CASP6CTDSP1

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-4216165-A Amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 — — US disclosed
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