SCHEMBL26334263

SCHEMBL26334263

CC(C)NC(=O)c1cc(=O)[nH]c2ccccc12

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.76
KMT2A Q03164 7/20 0.71
ALDH1A1 P00352 5/20 0.69
HPGD P15428 2/20 0.69
CYP1A2 P05177 1/20 0.69
HTT P42858 1/20 0.69
HSD17B10 Q99714 2/20 0.66
PKM P14618 1/20 0.65
MEN1 O00255 4/20 0.61
GFER P55789 1/20 0.61
TP53 P04637 1/20 0.60
LMNA P02545 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57

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
SCHEMBL14830559 0.83 KDM4E (0.69) KDM4EKMT2AALDH1A1HPGDHSD17B10
SCHEMBL2799377 0.80 KDM4E (0.71) KDM4EKMT2AALDH1A1HPGDCYP1A2
SCHEMBL13753409 0.77 NR4A2 (0.64) KDM4EKMT2AALDH1A1MEN1LMNA
SCHEMBL30172555 0.76 KDM4E (0.63) KDM4EKMT2AALDH1A1HPGDCYP1A2
SCHEMBL8729784 0.76 KDM4E (0.63) KDM4EKMT2AALDH1A1HPGDCYP1A2
SCHEMBL15193688 0.75 KDM4E (0.59) KDM4EKMT2AALDH1A1HPGDHSD17B10
SCHEMBL14572691 0.75 KDM4E (0.72) KDM4EKMT2AALDH1A1HPGDCYP1A2
SCHEMBL31343793 0.74 KDM4E (0.64) KDM4EKMT2AALDH1A1HPGDCYP1A2
Hydrochloric Acid SCHEMBL26649422 0.74 KDM4E (0.61) KDM4EKMT2AALDH1A1HPGDCYP1A2
SCHEMBL14829872 0.74 KDM4E (0.64) KDM4EKMT2AALDH1A1HPGDCYP1A2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4249480-A1 DIPHENYLPYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Northwest A&F University (CN) 2023-09-27 EP disclosed