SCHEMBL6200311

SCHEMBL6200311

Cn1ccc(=O)c(O)c1C(O)c1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
KDM6A O15550 1/20 0.45
KDM4A O75164 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
KDM5C P41229 1/20 0.45
KDM2B Q8NHM5 1/20 0.45
DOHH Q9BU89 1/20 0.45
KDM2A Q9Y2K7 1/20 0.45
LIPG Q9Y5X9 1/20 0.34
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
PTGS2 P35354 1/20 0.32
HSD17B2 P37059 1/20 0.32
DAO P14920 1/20 0.31
AOC3 Q16853 1/20 0.31
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31

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
SCHEMBL6200147 0.86 KDM4E (0.50) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL6201007 0.85 KDM4E (0.45) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL6193484 0.84 KDM4E (0.47) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL6198544 0.81 KDM4E (0.35) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL6196542 0.80 KMT2A (0.33) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL2608129 0.77 KDM4E (0.57) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL6194787 0.76 KMT2A (0.38) KDM4EALDH1A1HPGDL3MBTL1KMT2A
SCHEMBL8850313 0.75 TBXA2R (0.40) ALDH1A1KMT2A
SCHEMBL2115420 0.75 KDM4E (0.55) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL13555534 0.75 KDM4E (0.55) KDM4EKDM6AKDM4ACYP2C9CYP2C19

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-0768302-B1 Hydroxypyridinones NOVARTIS AG (CH) 2005-07-06 EP disclosed
US-5688815-A COMPOUNDS FOR REMOVAL OF EXCESS IRON IN MAMMALS CIBA GEIGY CORPORATION (US) 1997-11-18 US disclosed