SCHEMBL16627893

SCHEMBL16627893

CCN(C(=O)c1cc2ccccc2[nH]c1=O)c1ccc(Br)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 9/20 0.49
KDM4E B2RXH2 8/20 0.49
SMN1; SMN2 Q16637 7/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TSHR P16473 2/20 0.47
LMNA P02545 4/20 0.47
GAA P10253 1/20 0.47
RECQL P46063 1/20 0.46
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 3/20 0.44
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPK1 P28482 1/20 0.43
RXFP1 Q9HBX9 1/20 0.41
ALOX15 P16050 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
SCHEMBL16627777 0.90 SMN1; SMN2 (0.58) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16627596 0.89 KMT2A (0.52) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16627718 0.89 MEN1 (0.64) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16627838 0.88 KMT2A (0.51) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16627842 0.88 KMT2A (0.51) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16627597 0.85 KMT2A (0.48) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16627849 0.84 ALDH1A1 (0.57) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16627620 0.84 ALDH1A1 (0.49) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL34468718 0.79 KDM4E (0.62) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16627896 0.77 PARP1 (0.40) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2

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