SCHEMBL8664634

SCHEMBL8664634

CNC(=O)c1ncccc1C(=O)Nc1cccc(Cl)c1C

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.62
ALDH1A1 P00352 3/20 0.62
MAPT P10636 1/20 0.55
DHODH Q02127 1/20 0.54
KDR P35968 1/20 0.52
TOP1 P11387 1/20 0.52
PABPC1 P11940 1/20 0.51
EIF4H Q15056 1/20 0.51
GAA P10253 1/20 0.50
KMT2A Q03164 2/20 0.48
RXFP1 Q9HBX9 1/20 0.47

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
SCHEMBL8901777 0.89 ALDH1A1 (0.79) KDM4EALDH1A1MAPTDHODHKDR
SCHEMBL8664992 0.86 ALDH1A1 (0.67) KDM4EALDH1A1MAPTDHODHKDR
SCHEMBL8667765 0.85 ALDH1A1 (0.56) KDM4EALDH1A1MAPTDHODHKDR
SCHEMBL28442197 0.77 NPC1 (0.76) ALDH1A1MAPTGAAKMT2ARXFP1
SCHEMBL1507135 0.76 ALDH1A1 (0.45) KDM4EALDH1A1MAPTKDRGAA
Hydrochloric Acid SCHEMBL28079784 0.75 NPC1 (0.46) KDM4EALDH1A1KDRGAA
SCHEMBL7825161 0.74 MAPT (0.68) KDM4EALDH1A1MAPTDHODHKMT2A
SCHEMBL29168828 0.74 MAPT (0.65) KDM4EALDH1A1MAPTTOP1KMT2A
SCHEMBL8665346 0.74 ALDH1A1 (0.54) KDM4EALDH1A1MAPTDHODHKMT2A
SCHEMBL28678450 0.74 KDR (0.74) KDM4EMAPTDHODHKDRTOP1

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-5843868-A Pryidine-2,3-dicarboxylic acid diamide derivatives and herbicides comprising said derivatives as active ingredient NIHON NOHYAKU CO., LTD. (JP) 1998-12-01 US disclosed
EP-0799825-A1 Pyridine-2,3-dicarboxylic acid diamide derivatives and herbicides comprising said derivatives as active ingredient NIHON NOHYAKU CO., LTD. (JP) 1997-10-08 EP disclosed