Sugi Predict

Sugi Predict / Compounds / SCHEMBL25849361

SCHEMBL25849361

SCHEMBL25849361

CC1(C)c2ccccc2Oc2cccc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4cccc5cccc3c45)c21

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.41
▸ ATM Q13315 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ TYMS P04818 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL25847499 0.92 KDM4E (0.33) MAPK1ATMKDM4E
SCHEMBL25849424 0.88 MAPK1 (0.44) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25848315 0.88 MAPK1 (0.33) MAPK1ATMKDM4EALDH1A1TSHR
SCHEMBL25849360 0.86 MAPK1 (0.37) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25852348 0.86 KDM4E (0.38) MAPK1ATMKDM4E
SCHEMBL25847686 0.85 KDM4E (0.33) MAPK1ATMKDM4E
SCHEMBL25850325 0.84 KDM4E (0.33) MAPK1ATMKDM4E
SCHEMBL25849935 0.84 KDM4E (0.38) MAPK1ATMKDM4ETYMS
SCHEMBL25849369 0.84 KDM4E (0.40) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL25848892 0.81 KDM4E (0.35) MAPK1ATMKDM4E

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