SCHEMBL11438773

SCHEMBL11438773

Cc1cc(C(=O)Nc2cc(O)c3cccc(S(=O)(=O)O)c3c2)ccc1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ CYP1A2 P05177 2/20 0.42
▸ AURKA O14965 1/20 0.41
▸ AURKB Q96GD4 1/20 0.41
▸ ENPP2 Q13822 2/20 0.40
▸ TTR P02766 1/20 0.40
▸ MAPT P10636 5/20 0.40
▸ STAT3 P40763 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ HPSE Q9Y251 2/20 0.39
▸ ENPP3 O14638 1/20 0.39
▸ ENTPD3 O75355 1/20 0.39
▸ NR1I2 O75469 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ TDP2 O95551 1/20 0.39
▸ CBX7 O95931 1/20 0.39

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
SCHEMBL11440789 0.91 CASP6 (0.43) CASP6CTDSP1CYP1A2AURKAAURKB
SCHEMBL11428137 0.87 CASP6 (0.47) CASP6CTDSP1CYP1A2ENPP2MAPT
SCHEMBL11345207 0.86 HPSE (0.50) CYP1A2MAPTMEN1KMT2AHPSE
SCHEMBL10907541 0.86 HPSE (0.46) CASP6CTDSP1CYP1A2ENPP2MAPT
SCHEMBL11430988 0.85 CASP6 (0.59) CASP6CTDSP1ENPP2TTRMAPT
SCHEMBL11425978 0.84 ULK1 (0.50) CASP6CTDSP1TTRSTAT3MEN1
SCHEMBL11425190 0.83 MEN1 (0.56) MAPTTP53MEN1KMT2ATDP1
SCHEMBL11439440 0.83 TTR (0.43) CASP6CTDSP1CYP1A2AURKAAURKB
SCHEMBL11438775 0.83 PLG (0.42) CYP1A2AURKAAURKBTTRTP53
SCHEMBL11438820 0.82 CASP6 (0.40) CASP6CTDSP1AURKAAURKBENPP2

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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