SCHEMBL11425014

SCHEMBL11425014

Nc1ccc(C(=O)Nc2cc(S(=O)(=O)O)c3cc(O)ccc3c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 1/20 0.57
▸ CTDSP1 Q9GZU7 1/20 0.57
▸ ENPP2 Q13822 2/20 0.53
▸ POLB P06746 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ APEX1 P27695 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ NQO2 P16083 1/20 0.46
▸ PRMT1 Q99873 3/20 0.42
▸ SNCA P37840 1/20 0.42
▸ PTGS1 P23219 2/20 0.41
▸ NT5E P21589 1/20 0.41
▸ SETD7 Q8WTS6 1/20 0.41

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
SCHEMBL10909144 0.88 ENPP2 (0.56) CASP6CTDSP1ENPP2KMT2ACA1
SCHEMBL11343949 0.88 ENPP2 (0.56) CASP6CTDSP1ENPP2NQO2PRMT1
SCHEMBL11433027 0.87 KAT6A (0.46) CASP6CTDSP1ENPP2MEN1PKM
SCHEMBL11427784 0.85 CASP6 (0.60) CASP6CTDSP1ENPP2POLBMEN1
SCHEMBL11433813 0.85 ENPP2 (0.46) CASP6CTDSP1ENPP2MEN1LMNA
SCHEMBL11435436 0.85 ENPP2 (0.46) CASP6CTDSP1ENPP2MEN1LMNA
SCHEMBL11425189 0.83 CD40 (0.53) CASP6ENPP2POLBMEN1LMNA
SCHEMBL10326996 0.82 ENPP2 (0.71) CASP6CTDSP1ENPP2POLBMEN1
SCHEMBL11427680 0.81 CASP6 (0.59) CASP6CTDSP1ENPP2POLBMEN1
SCHEMBL11433010 0.80 CASP6 (0.67) CASP6CTDSP1ENPP2POLBMEN1

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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