SCHEMBL11424939

SCHEMBL11424939

Nc1ccc(C(=O)Nc2ccc3ccc(S(=O)(=O)O)cc3c2O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 3/20 0.57
CTDSP1 Q9GZU7 1/20 0.57
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
APEX1 P27695 2/20 0.45
NT5E P21589 2/20 0.44
TIMP3 P35625 2/20 0.43
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
PRMT1 Q99873 3/20 0.42
HDAC1 Q13547 2/20 0.41
TSHR P16473 1/20 0.41
ENPP2 Q13822 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 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
SCHEMBL11425433 0.91 CASP6 (0.62) CASP6CTDSP1CA12CA1CA2
SCHEMBL11438818 0.87 HSD17B10 (0.51) CASP6CTDSP1APEX1NT5ETIMP3
SCHEMBL11351829 0.86 TIMP3 (0.58) CASP6CTDSP1CA1CA2APEX1
SCHEMBL10909096 0.86 TIMP3 (0.50) CASP6CTDSP1CA12CA1CA2
SCHEMBL11425755 0.85 MAPT (0.42) CASP6CTDSP1APEX1TIMP3ALDH1A1
SCHEMBL11433102 0.85 CASP6 (0.42) CASP6CTDSP1APEX1TIMP3ALDH1A1
SCHEMBL11431164 0.84 MAPT (0.56) CASP6ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL11436818 0.82 CASP6 (0.63) CASP6CTDSP1CA12CA1CA2
SCHEMBL11425964 0.82 CASP6 (0.60) CASP6CTDSP1CA12CA1CA2
SCHEMBL11440941 0.82 CASP6 (0.60) CASP6CTDSP1CA12CA1CA2

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