SCHEMBL27902102

SCHEMBL27902102

N#Cc1ccc(C2=NN(c3ccccn3)C(c3ccc(F)cc3)C2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 15/20 0.60
GAA P10253 2/20 0.53
MEN1 O00255 1/20 0.53
HSP90AA1 P07900 1/20 0.53
KMT2A Q03164 1/20 0.53
KCNH2 Q12809 2/20 0.52
EGFR P00533 1/20 0.48
ERBB2 P04626 1/20 0.48
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
GLA P06280 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL27714731 0.82 NR3C2 (0.66) NR3C2GAAMEN1HSP90AA1KMT2A
SCHEMBL6298090 0.78 ESD (0.61) GAAMEN1HSP90AA1KMT2AEGFR
SCHEMBL31429938 0.76 NR3C2 (0.63) NR3C2GAAMEN1HSP90AA1KMT2A
SCHEMBL27694764 0.76 NR3C2 (0.64) NR3C2GAAMEN1HSP90AA1KMT2A
SCHEMBL27997398 0.76 ESD (0.61) GAAMEN1HSP90AA1KMT2AEGFR
SCHEMBL4254323 0.74 MEN1 (0.87) NR3C2GAAMEN1HSP90AA1KMT2A
SCHEMBL31429937 0.72 MEN1 (0.82) NR3C2GAAMEN1HSP90AA1KMT2A
SCHEMBL7586677 0.70 MEN1 (0.53) NR3C2GAAMEN1HSP90AA1KMT2A
SCHEMBL27955194 0.69 MEN1 (1.00) NR3C2GAAMEN1HSP90AA1KMT2A
SCHEMBL4592755 0.68 MEN1 (0.67) NR3C2GAAMEN1HSP90AA1KMT2A

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
CN-101062916-B Three-substituted 1H-pyrromonazole compound, preparation method, medicament composition and pharmacy use thereof INST PHARM & TOXICOLOGY AMMS 2012-12-26 CN disclosed