SCHEMBL25847803

SCHEMBL25847803

c1ccc2c(c1)Oc1cc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4c3ccc3ccccc43)ccc1C21c2ccccc2-c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ATM Q13315 2/20 0.33
MAPK1 P28482 1/20 0.33
GPR84 Q9NQS5 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
RAB9A P51151 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL25847804 0.94 KDM4E (0.33) KDM4EATMMAPK1GPR84ALDH1A1
SCHEMBL25847917 0.93 KDM4E (0.32) KDM4EATMMAPK1
SCHEMBL25850333 0.92 KDM4E (0.31) KDM4EATMMAPK1
SCHEMBL25847690 0.92 KDM4E (0.31) KDM4EATMMAPK1
SCHEMBL25879339 0.92 KDM4E (0.33) KDM4EATMMAPK1GPR84ALDH1A1
SCHEMBL25856496 0.91 GPR84 (0.32) GPR84
SCHEMBL25864083 0.91 DNMT1 (0.32) KDM4EATMMAPK1
SCHEMBL25847681 0.91 DNMT1 (0.32) KDM4EATMMAPK1
SCHEMBL25847506 0.90 FTO (0.34) KDM4EATMMAPK1ALDH1A1CYP2C19
SCHEMBL25851187 0.90 GPR84 (0.31) GPR84

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-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed