SCHEMBL9230925

SCHEMBL9230925

CCOC(=O)c1c2n(c3cc(-c4ccc(NC(=O)C(F)(F)F)cc4)c(F)cc3c1=O)C(CF)S2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 1/20 0.35
GNRHR P30968 1/20 0.35
NPY5R Q15761 2/20 0.34
PDK1 Q15118 1/20 0.34
PDK2 Q15119 1/20 0.34
PDK3 Q15120 1/20 0.34
PDK4 Q16654 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TP53 P04637 2/20 0.33
PKM P14618 1/20 0.33
BDKRB1 P46663 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL9231061 0.89 PKM (0.34) TRPM8KDM4EALDH1A1GAAHPGD
SCHEMBL9229230 0.86 KDM4E (0.42) KDM4EALDH1A1GAAHPGDMEN1
SCHEMBL9230920 0.85 TOP2A (0.37) PRKCZNPY5RPDK1PDK2PDK3
SCHEMBL9229273 0.81 KMT2A (0.44) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL9568409 0.79 LMNA (0.39) PRKCZGNRHRKDM4EALDH1A1GAA
SCHEMBL9568297 0.77 KDM4E (0.45) PRKCZKDM4EALDH1A1GAAHPGD
SCHEMBL9568806 0.76 LMNA (0.41) PRKCZKDM4EALDH1A1GAAHPGD
SCHEMBL9568347 0.75 PRKCZ (0.43) PRKCZKDM4EALDH1A1GAAHPGD
SCHEMBL9568369 0.75 LMNA (0.40) PRKCZKDM4EALDH1A1GAAHPGD
SCHEMBL9568344 0.75 ALDH1A1 (0.43) KDM4EALDH1A1GAAHPGDMEN1

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-0675127-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE AND PROCESS FOR PRODUCING THE SAME NIPPON SHINYAKU COMPANY, LIMITED (JP) 1995-10-04 EP disclosed