SCHEMBL29200848

SCHEMBL29200848

O=c1ccc2c(-c3ccccc3)cccc2n1Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.59
P2RX4 Q99571 1/20 0.53
KMT2A Q03164 3/20 0.52
KDM4E B2RXH2 3/20 0.52
MEN1 O00255 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 2/20 0.52
CCR2 P41597 1/20 0.52
CYP19A1 P11511 1/20 0.50
NTRK1 P04629 1/20 0.48
MAPK1 P28482 1/20 0.46
PGR P06401 1/20 0.44
CFTR P13569 1/20 0.43
HSD17B10 Q99714 2/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MIF P14174 1/20 0.42

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
SCHEMBL30783435 1.00 MAPK14 (0.59) MAPK14P2RX4KMT2AKDM4EMEN1
SCHEMBL30783430 0.80 KMT2A (0.70) P2RX4KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL29200844 0.80 KMT2A (0.70) P2RX4KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL4069762 0.75 CFTR (0.47) P2RX4KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL10642119 0.74 KMT2A (0.64) P2RX4KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL11296345 0.73 MAPK14 (0.47) MAPK14KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL30783405 0.71 MEN1 (0.55) P2RX4KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL29200804 0.71 MEN1 (0.55) P2RX4KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL2260831 0.70 GSK3A (0.48) P2RX4KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL21023182 0.70 P2RX4 (0.53) P2RX4KMT2AKDM4EMEN1SMN1; 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
CN-117624043-A Preparation method of quinolinone compound 安徽中医药大学 2024-03-01 CN disclosed