SCHEMBL7586677

SCHEMBL7586677

c1ccc(C2=NN(c3ccccn3)C(c3ccccc3)C2)cc1.c1ccc(C2CC(c3ccccn3)=NN2c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.53
KMT2A Q03164 11/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
PRKCZ Q05513 3/20 0.53
ESD P10768 1/20 0.53
EGFR P00533 2/20 0.51
ERBB2 P04626 2/20 0.51
ATM Q13315 6/20 0.51
KDM4E B2RXH2 4/20 0.51
GAA P10253 3/20 0.51
GLA P06280 3/20 0.51
ALDH1A1 P00352 3/20 0.51
MAPT P10636 3/20 0.51
HTT P42858 1/20 0.51
GFER P55789 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CFTR P13569 1/20 0.51
HPGD P15428 1/20 0.51
GOPC Q9HD26 1/20 0.51

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
SCHEMBL6298090 0.90 ESD (0.61) MEN1KMT2AL3MBTL1PRKCZESD
SCHEMBL6292757 0.89 PRKCZ (0.62) MEN1KMT2AL3MBTL1PRKCZESD
SCHEMBL23052404 0.82 MEN1 (0.73) MEN1KMT2AL3MBTL1PRKCZEGFR
SCHEMBL395608 0.82 MEN1 (0.73) MEN1KMT2AL3MBTL1PRKCZEGFR
SCHEMBL27997398 0.81 ESD (0.61) MEN1KMT2AL3MBTL1PRKCZESD
SCHEMBL6293056 0.80 CA1 (0.56) MEN1KMT2AL3MBTL1PRKCZEGFR
SCHEMBL6294114 0.80 CA1 (0.56) MEN1KMT2AL3MBTL1PRKCZESD
SCHEMBL10361833 0.79 MEN1 (0.69) MEN1KMT2AL3MBTL1PRKCZEGFR
SCHEMBL13680425 0.79 EGFR (0.75) MEN1KMT2AL3MBTL1PRKCZEGFR
SCHEMBL14338087 0.79 MEN1 (0.69) MEN1KMT2AL3MBTL1EGFRERBB2

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
WO-2002089799-A2 USE OF DIHYDROPYRAZOLES TO INCREASE ERYTHROPOIETIN AND VASCULARI ZATION THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed