SCHEMBL27671398

SCHEMBL27671398

NC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2Cl)cc1C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 3/20 0.55
▸ KMT2A Q03164 2/20 0.42
▸ ATM Q13315 1/20 0.42
▸ PDK2 Q15119 1/20 0.42
▸ MKNK1 Q9BUB5 1/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ ALPL P05186 1/20 0.38
▸ EIF4E P06730 1/20 0.38
▸ IKBKB O14920 5/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ CHUK O15111 3/20 0.36
▸ ADRA1D P25100 1/20 0.36

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
SCHEMBL27614869 0.92 AHR (0.50) AHRKMT2AATMPDK2MKNK1
SCHEMBL3121452 0.76 KMT2A (0.55) KMT2AATMMKNK1MKNK2ALDH1A1
SCHEMBL17373230 0.75 PARP1 (0.51) AHRPDK2
SCHEMBL27370679 0.72 BCAT2 (0.52) KMT2AATMPDK2EIF4EALDH1A1
SCHEMBL3790275 0.72 ALDH1A1 (0.60) KMT2AATMALDH1A1MAPTHTT
SCHEMBL2282125 0.72 AHR (1.00) AHRKMT2AMAPTHTT
SCHEMBL7068918 0.70 BCAT2 (0.58) KMT2AATMPDK2MKNK1MKNK2
SCHEMBL27660734 0.70 MKNK1 (0.48) AHRMKNK1MKNK2ALPL
SCHEMBL895613 0.69 KMT2A (0.52) KMT2AATMMKNK1MKNK2ALDH1A1
SCHEMBL11735266 0.69 KMT2A (0.52) KMT2AATMMKNK1MKNK2ALDH1A1

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
CN-100443468-C Process for preparing 2-halobenzamide compounds NIHON NOHYAKU CO LTD (JP) 2008-12-17 — — CN disclosed
CN-1906158-A Process for preparing 2-halobenzamide compounds NIHON NOHYAKU CO LTD (JP) 2007-01-31 — — CN disclosed
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