SCHEMBL16627632

SCHEMBL16627632

CCN(c1ccccc1)c1cc2ccccc2[nH]c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 1/20 0.55
CASP3 P42574 1/20 0.55
CASP6 P55212 1/20 0.55
SENP8 Q96LD8 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
BRD4 O60885 1/20 0.49
ALDH1A1 P00352 7/20 0.48
HSD17B10 Q99714 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
ALOX15 P16050 1/20 0.48
KDM4E B2RXH2 10/20 0.46
KMT2A Q03164 2/20 0.46
TSHR P16473 1/20 0.46
DAO P14920 1/20 0.45
DDO Q99489 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
CYP1A2 P05177 1/20 0.44
MAPT P10636 3/20 0.43

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
SCHEMBL16627798 0.90 BRD4 (0.45) APAF1CASP3CASP6SENP8SENP7
SCHEMBL16627566 0.89 BRD4 (0.44) APAF1CASP3CASP6SENP8SENP7
SCHEMBL16627811 0.89 BRD4 (0.44) APAF1CASP3CASP6SENP8SENP7
SCHEMBL16627812 0.89 DAO (0.48) APAF1CASP3CASP6SENP8SENP7
SCHEMBL16627565 0.87 ALDH1A1 (0.56) CASP3SENP8SENP7SENP6ALDH1A1
SCHEMBL16627649 0.87 APAF1 (0.42) APAF1CASP3CASP6SENP8SENP7
SCHEMBL16627648 0.87 KDM4E (0.44) APAF1CASP3CASP6SENP8SENP7
SCHEMBL16627642 0.85 MEN1 (0.43) APAF1CASP3CASP6SENP8SENP7
SCHEMBL28599651 0.81 BRD4 (0.54) BRD4ALDH1A1HSD17B10SMN1; SMN2LMNA
SCHEMBL10774671 0.81 DAO (0.50) APAF1CASP3CASP6SENP8SENP7

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