SCHEMBL25874200

SCHEMBL25874200

c1ccc2c(c1)-c1ccc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4c3ccc3ccccc43)cc1C21c2ccc3ccccc3c2Oc2c1ccc1ccccc21

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.32
DNMT1 P26358 1/20 0.31
KDM4E B2RXH2 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
ATM Q13315 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PDK2 Q15119 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
SCHEMBL25876105 0.98 PDK2 (0.31) GPR84DNMT1KDM4EALDH1A1CYP1A2
SCHEMBL25874504 0.94 DNMT1 (0.33) GPR84DNMT1PDK2
SCHEMBL25876500 0.92 KIF11 (0.31) GPR84KDM4E
SCHEMBL25874429 0.92 GPR84 (0.32) GPR84DNMT1
SCHEMBL25876736 0.90 DRD1 (0.32)
SCHEMBL25877315 0.89 GPR84 (0.35) GPR84ALDH1A1RAB9APDK2
SCHEMBL25864271 0.89 GPR84 (0.31) GPR84DNMT1
SCHEMBL25874824 0.88 PDK2 (0.35) KDM4EALDH1A1CYP1A2CYP2C19RAB9A
SCHEMBL25864270 0.87 DNMT1 (0.31) DNMT1PDK2
SCHEMBL25847684 0.86 GPR84 (0.31) GPR84DNMT1

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