SCHEMBL8667765

SCHEMBL8667765

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

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
KDM4E B2RXH2 3/20 0.56
HTT P42858 1/20 0.53
GAA P10253 1/20 0.51
KMT2A Q03164 1/20 0.49
DHODH Q02127 1/20 0.49
MAPT P10636 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TOP1 P11387 1/20 0.48
MT-CO2 P00403 1/20 0.48
KDR P35968 1/20 0.47
PABPC1 P11940 1/20 0.46
EIF4H Q15056 1/20 0.46
AGER Q15109 1/20 0.46
PTGES O14684 1/20 0.45

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
SCHEMBL8664634 0.85 KDM4E (0.62) ALDH1A1KDM4EGAAKMT2ADHODH
SCHEMBL8664992 0.83 ALDH1A1 (0.67) ALDH1A1KDM4EKMT2ADHODHMAPT
SCHEMBL8901777 0.83 ALDH1A1 (0.79) ALDH1A1KDM4EGAAKMT2ADHODH
SCHEMBL30131325 0.79 PDE4B (0.48) KMT2ANPC1RAB9A
SCHEMBL8664999 0.78 HTT (0.46) ALDH1A1KDM4EHTTGAAKMT2A
SCHEMBL9213267 0.74 KDM4E (0.61) ALDH1A1KDM4EHTTKMT2AMAPT
SCHEMBL28442197 0.73 NPC1 (0.76) ALDH1A1GAAKMT2AMAPTNPC1
SCHEMBL31432092 0.73 KDM4E (0.62) ALDH1A1KDM4EHTTGAAKMT2A
SCHEMBL7679306 0.72 ALDH1A1 (0.40) ALDH1A1KDM4EHTTGAAKMT2A
SCHEMBL30131475 0.72 HPGD (0.60) ALDH1A1HTTNPC1RAB9A

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