SCHEMBL10516655

SCHEMBL10516655

CCOC(=O)c1c(O)c2cc(F)c(Br)c(F)c2[nH]c1=O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.47
KDM5B Q9UGL1 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.42
ALOX5 P09917 5/20 0.41
PTGES O14684 3/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL31174999 0.88 KDM5A (0.46) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL30240636 0.88 KDM5A (0.46) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL23951030 0.88 KDM5A (0.46) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL25187813 0.88 KDM5A (0.46) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL6201222 0.81 KDM5A (0.50) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL30197952 0.81 KDM5A (0.40) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL6198339 0.80 KDM5A (0.48) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL5500146 0.77 KDM5A (0.44) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL31433701 0.77 KDM5A (0.54) KDM5AKDM5BKDM4EALDH1A1LMNA
SCHEMBL4647324 0.74 ALDH1A1 (0.51) KDM5AKDM5BKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0184384-B1 SUBSTITUTED DIHYDROQUINOLONE CARBOXYLIC ACIDS, ANTI-BACTERIAL COMPOSITIONS CONTAINING THEM PFIZER INC. (US) 1989-08-02 EP disclosed
US-4623650-A BACTERICIDES PFIZER INC. (US) 1986-11-18 US disclosed
EP-0184384-A1 Substituted dihydroquinolone carboxylic acids, anti-bacterial compositions containing them PFIZER INC. (US) 1986-06-11 EP disclosed