SCHEMBL9566919

SCHEMBL9566919

Cc1cc(=O)n(-c2ccccc2-c2ccccc2-c2nnn[nH]2)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
NQO2 P16083 1/20 0.41
CHEK1 O14757 3/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 3/20 0.35
RAB9A P51151 3/20 0.34
HPGD P15428 2/20 0.34
PLK1 P53350 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 3/20 0.33
NPC1 O15118 2/20 0.33
LMNA P02545 2/20 0.33
NTRK1 P04629 1/20 0.32
ALOX5 P09917 1/20 0.32
IDO1 P14902 1/20 0.32
PTGS2 P35354 1/20 0.32
HTT P42858 1/20 0.32
MAPK8 P45983 1/20 0.32
TDO2 P48775 1/20 0.32

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
SCHEMBL9229400 0.75 IDH1 (0.30)
SCHEMBL9337518 0.73 APLNR (0.34)
SCHEMBL9566905 0.72 KDM4E (0.46) KDM4ENQO2KMT2AMEN1ALDH1A1
SCHEMBL15714404 0.70 GAA (0.41) KDM4EKMT2AMEN1ALDH1A1HTT
SCHEMBL9571274 0.70 CYP17A1 (0.35) CYP1A2
SCHEMBL9570987 0.70 AGTR1 (0.33) KDM4EALDH1A1HPGD
SCHEMBL9571028 0.70 AGTR1 (0.34) KDM4EALDH1A1HPGD
SCHEMBL27761643 0.70 GAA (0.44) KDM4EKMT2AMEN1ALDH1A1RAB9A
SCHEMBL9571295 0.69 AGTR1 (0.31)
Hydrochloric Acid SCHEMBL27741149 0.68 GAA (0.43) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2

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
EP-0561252-A1 2-Oxoquinoline derivatives as angiotensin II antagonists MERCK PATENT GmbH (DE) 1993-09-22 EP claimed