SCHEMBL16627828

SCHEMBL16627828

O=C(Cc1ccc(Cl)cc1)Nc1cccc2[nH]c(=O)c(C(=O)Nc3ccc(O)cc3)cc12

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 4/20 0.52
KDM4E B2RXH2 6/20 0.48
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
MAPT P10636 3/20 0.48
GAA P10253 1/20 0.48
NLRP3 Q96P20 1/20 0.47
ALDH1A1 P00352 4/20 0.46
TP53 P04637 1/20 0.46
POLB P06746 2/20 0.46
HPGD P15428 1/20 0.46
TRPV1 Q8NER1 3/20 0.43
CYP1A2 P05177 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL16627678 0.92 PARP14 (0.52) PARP14KDM4EMEN1KMT2AMAPT
SCHEMBL16627690 0.88 RXFP1 (0.40) PARP14KDM4EMEN1KMT2AMAPT
SCHEMBL16627806 0.82 NHERF1 (0.49) KDM4EMEN1KMT2AMAPTGAA
SCHEMBL16627760 0.81 CCNA2 (0.45) PARP14KDM4EMEN1KMT2AGAA
SCHEMBL16627890 0.80 PARP14 (0.56) PARP14KDM4EMEN1KMT2AMAPT
SCHEMBL16627825 0.80 KMT2A (0.53) PARP14KDM4EKMT2AMAPTGAA
SCHEMBL16627824 0.79 MEN1 (0.47) KDM4EMEN1KMT2AMAPTGAA
SCHEMBL16627710 0.79 KMT2A (0.52) PARP14KDM4EMEN1KMT2AMAPT
SCHEMBL16627592 0.79 MT-CO2 (0.44) PARP14KDM4EMEN1KMT2AGAA
SCHEMBL16627823 0.78 NPY5R (0.47) KDM4EMEN1KMT2AMAPTNLRP3

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
WO-2015050379-A1 NOVEL QUINOLINONE DERIVATIVE AND USE THEREOF 광주과학기술원 2015-04-09 WO disclosed