SCHEMBL8946384

SCHEMBL8946384

Cc1nc(-c2ccccc2)nc(-c2ccccc2Cl)c1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 2/20 0.49
DPP4 P27487 1/20 0.48
DHODH Q02127 4/20 0.46
TSHR P16473 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
LMNA P02545 2/20 0.45
HSD17B10 Q99714 2/20 0.44
TP53 P04637 2/20 0.44
RAB9A P51151 2/20 0.44
FABP3 P05413 1/20 0.44
FABP4 P15090 1/20 0.44
PDE10A Q9Y233 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
RXRA P19793 1/20 0.41

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
SCHEMBL4459937 0.87 FABP3 (0.52) KMT2AKDM4EDPP4DHODHALDH1A1
SCHEMBL8946850 0.85 KDM4E (0.62) KMT2AKDM4ETSHRALDH1A1GAA
SCHEMBL4395939 0.80 KDM4E (0.65) KMT2AL3MBTL1KDM4ETSHRALDH1A1
SCHEMBL10377531 0.77 KDM4E (0.51) KMT2AKDM4EDHODHTSHRALDH1A1
SCHEMBL10475598 0.76 DHODH (0.52) KMT2AKDM4EDPP4DHODHTSHR
SCHEMBL4460195 0.75 PLA2G2A (0.53) KMT2AKDM4EDPP4TSHRALDH1A1
SCHEMBL8946710 0.74 HTT (0.47) KMT2AL3MBTL1DPP4TSHRALDH1A1
SCHEMBL8946509 0.73 L3MBTL1 (0.60) KMT2AL3MBTL1KDM4EDPP4ALDH1A1
SCHEMBL10375294 0.73 KMT2A (0.48) KMT2AL3MBTL1KDM4EALDH1A1GAA
SCHEMBL8946825 0.72 DHODH (0.41) KMT2AL3MBTL1DPP4DHODHTSHR

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
US-5500424-A ENZYME INHIBITORS NIHON NOHYAKU CO., LTD. (JP) 1996-03-19 US disclosed
EP-0638557-A1 N-phenylpyri(mi)dine-N'-phenyl-urea derivatives, their preparation and their use as ACAT inhibitors NIHON NOHYAKU CO., LTD. (JP) 1995-02-15 EP disclosed