SCHEMBL11301646

SCHEMBL11301646

CC(Oc1ccccc1)C(Cl)C(=O)Nc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
RXFP1 Q9HBX9 2/20 0.54
ALDH1A1 P00352 5/20 0.53
MAPT P10636 4/20 0.53
ATM Q13315 3/20 0.53
GAA P10253 3/20 0.53
LMNA P02545 2/20 0.53
TSHR P16473 1/20 0.52
POLB P06746 1/20 0.52
HTT P42858 2/20 0.51
HSP90AA1 P07900 2/20 0.50
GPR55 Q9Y2T6 1/20 0.50
TP53 P04637 1/20 0.49
HPGD P15428 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KLK7 P49862 1/20 0.46

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
SCHEMBL5940992 0.84 ALDH1A1 (0.56) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL14653107 0.81 KLK7 (0.58) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL13532261 0.80 KMT2A (0.77) MEN1KMT2ARXFP1ALDH1A1ATM
SCHEMBL29988895 0.80 MEN1 (0.54) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL10572607 0.80 MAPT (0.62) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL2516508 0.76 ALDH1A1 (0.67) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL12724392 0.76 ALDH1A1 (0.57) MEN1KMT2ARXFP1ALDH1A1MAPT
Water SCHEMBL27691964 0.74 ALDH1A1 (0.65) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL11380977 0.74 ALDH1A1 (0.56) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL10700016 0.74 MAPT (0.51) MEN1KMT2ARXFP1ALDH1A1MAPT

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
JP-56015254-A None JP disclosed
JP-S5615254-A CHLOROACETANILIDE DERIVATIVE AND HERBICIDE CONTAINING THE SAME KUMIAI CHEM IND CO LTD 1981-02-14 JP disclosed