SCHEMBL26047893

SCHEMBL26047893

O=c1c2ccccc2c2cc(-c3cccc(-c4ccc5c6ccccc6c6ccccc6c5c4)c3)ccc2n1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.54
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.42
ALDH1A1 P00352 2/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.42
BRCA1 P38398 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PGR P06401 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
KDM4E B2RXH2 2/20 0.41
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
ATM Q13315 1/20 0.41
GAA P10253 1/20 0.40

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
SCHEMBL20227636 0.96 MAPK1 (0.49) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL26042859 0.96 MAPK1 (0.49) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL21636000 0.96 MAPK1 (0.49) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL21636060 0.95 MAPK1 (0.56) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL20227629 0.95 MAPK1 (0.56) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL26042863 0.95 MAPK1 (0.56) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL15999733 0.95 MAPK1 (0.59) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL20227624 0.95 MAPK1 (0.59) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL21636052 0.95 MAPK1 (0.49) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL21636067 0.94 KMT2A (0.55) MAPK1KMT2AMEN1ALDH1A1POLB

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-3823958-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-08-23 EP disclosed