SCHEMBL7828505

SCHEMBL7828505

CCOC(=O)c1c(O)c2c(OC(F)(F)F)c(C)ccc2[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.48
KDM5B Q9UGL1 1/20 0.48
MAP3K5 Q99683 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 1/20 0.42
CSF1R P07333 1/20 0.40
GAA P10253 1/20 0.39
APLNR P35414 1/20 0.39

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
SCHEMBL7754982 0.86 KDM5A (0.52) KDM5AKDM5BMAP3K5LMNAMAPT
SCHEMBL7754979 0.82 KDM5A (0.53) KDM5AKDM5BMAP3K5LMNAMAPT
SCHEMBL321963 0.81 KDM5A (0.54) KDM5AKDM5BMAP3K5LMNAMAPT
SCHEMBL1033018 0.80 KDM5A (0.53) KDM5AKDM5BMAP3K5LMNAMAPT
SCHEMBL7861387 0.77 KDM5A (0.50) KDM5AKDM5BMAP3K5LMNAMAPT
SCHEMBL7828560 0.75 GPBAR1 (0.40) LMNAMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL322275 0.74 USP2 (0.44) KDM5AKDM5BMEN1KMT2AALDH1A1
SCHEMBL14829878 0.74 GAA (0.51) KDM5AKDM5BLMNAMAPTMEN1
SCHEMBL321856 0.72 KDM5A (0.44) KDM5AKDM5BMAP3K5LMNAMAPT
SCHEMBL16029767 0.72 MAP3K5 (0.60) KDM5AKDM5BMAP3K5MAPTMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1095021-A1 QUINOLINE DERIVATIVES Active Biotech AB (SE) 2001-05-02 EP disclosed
WO-2000003991-A1 QUINOLINE DERIVATIVES ACTIVE BIOTECH AB (SE) 2000-01-27 WO disclosed