SCHEMBL12166134

SCHEMBL12166134

CCCCOc1ccc(OCCC)cc1C(=O)Nc1cc(-c2ccccc2)ccc1C=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
HDAC8 Q9BY41 4/20 0.44
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44
TP53 P04637 1/20 0.43
NR4A2 P43354 1/20 0.42
DHODH Q02127 1/20 0.42
ERN1 O75460 2/20 0.42
PTPN11 Q06124 3/20 0.42
NR1H4 Q96RI1 1/20 0.41
PLK1 P53350 1/20 0.41
PNLIP P16233 1/20 0.41
PPARG P37231 2/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
PTGES O14684 1/20 0.41

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
SCHEMBL12121662 0.94 KDM4E (0.44) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL12166052 0.89 KDM4E (0.47) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL12166015 0.89 LMNA (0.48) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL12166018 0.89 MEN1 (0.46) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL12166031 0.89 KMT2A (0.46) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL12121673 0.88 CREBBP (0.44) KDM4EALDH1A1HDAC1
SCHEMBL12121294 0.87 PTGES (0.43) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL12121675 0.87 HTR7 (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL12121512 0.84 DGAT1 (0.40) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL13206061 0.83 PLK1 (0.48) ADRB1ADRB3NR4A2DHODHPTPN11

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-2385036-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF Toyama Chemical Co., Ltd. (JP) 2011-11-09 EP disclosed