SCHEMBL9717209

SCHEMBL9717209

NNc1ccc(-c2ccc(NN)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
MAPT P10636 4/20 0.38
TDP1 Q9NUW8 4/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
POLB P06746 3/20 0.38
GAA P10253 2/20 0.38
RECQL P46063 2/20 0.38
CASP6 P55212 2/20 0.38
L3MBTL1 Q9Y468 2/20 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
SCHEMBL22852093 0.80 RAPGEF4 (0.39) RAPGEF4MAPTTDP1ALDH1A1KDM4E
SCHEMBL346242 0.80 ALDH1A1 (0.48) RAPGEF4CA12CA1CA2MAPT
SCHEMBL9080020 0.79 ENPP2 (0.59) RAPGEF4CA12CA1CA2CA4
SCHEMBL29899149 0.79 ENPP2 (0.59) RAPGEF4CA12CA1CA2CA4
SCHEMBL9080026 0.79 ENPP2 (0.59) RAPGEF4CA12CA1CA2CA4
SCHEMBL9079841 0.79 EGFR (0.41) RAPGEF4CA12CA1CA2CA4
SCHEMBL21589354 0.78 TNNI3 (0.46) RAPGEF4CA12CA1CA2CA4
SCHEMBL11690188 0.78 CYP3A4 (0.41) CA1CA2CA9MAPTTDP1
SCHEMBL10064489 0.77 RAPGEF4 (0.40) RAPGEF4CA12CA1CA2CA4
SCHEMBL19750554 0.75 RAPGEF4 (0.54) RAPGEF4CA12CA1CA2MAPT

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-5091466-A Insolubilization of soluble pre-imidized polyimides by polyhydrazine compounds GENERAL ELECTRIC COMPANY (US) 1992-02-25 US disclosed