SCHEMBL8794800

SCHEMBL8794800

Nc1c(-c2ccc(-c3ccccc3)cc2)nc2ccc(Cl)cc2c1OC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.56
GAA P10253 3/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP2C9 P11712 2/20 0.49
MAPT P10636 2/20 0.46
MAT2A P31153 1/20 0.46
POLB P06746 1/20 0.45
RAD52 P43351 1/20 0.45
KMT2A Q03164 1/20 0.45
PTGES O14684 1/20 0.44
ALOX5 P09917 1/20 0.44
HPGD P15428 1/20 0.44
CASP7 P55210 1/20 0.44
HIF1A Q16665 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FABP3 P05413 1/20 0.43
FABP4 P15090 1/20 0.43
KDM4E B2RXH2 3/20 0.43

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
SCHEMBL8794407 0.94 CDH1 (0.48) DHODHGAAALDH1A1CYP2C9PTGES
SCHEMBL8795005 0.90 DHODH (0.50) DHODHGAAALDH1A1CYP2C9PTGES
SCHEMBL8794037 0.89 DHODH (0.50) DHODHGAAALDH1A1CYP2C9KMT2A
SCHEMBL8794203 0.89 DHODH (0.44) DHODHGAAALDH1A1CYP2C9PTGES
SCHEMBL8795287 0.88 DHODH (0.48) DHODHLMNASMN1; SMN2
SCHEMBL8794351 0.86 DHODH (0.49) DHODHALDH1A1MAPTPOLBKMT2A
SCHEMBL8794864 0.86 KDM4E (0.50) DHODHGAAMAPTLMNAKDM4E
SCHEMBL8795058 0.85 DHODH (0.48) DHODHGAAALDH1A1KMT2AHPGD
SCHEMBL8794498 0.85 DHODH (0.67) DHODHALDH1A1POLBKMT2AKDM4E
SCHEMBL8794990 0.84 DHODH (0.51) DHODHKMT2ALMNA

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-0379145-B1 Substituted quinolinecarboxylic acids AMERICAN CYANAMID CO (US) 1997-05-07 EP claimed