SCHEMBL25875815

SCHEMBL25875815

CC1(C)c2ccccc2-c2ccc(-c3ccc4c5c(cccc35)-c3cc(-c5cccc6c5oc5ccccc56)ccc3O4)cc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.44
PRKDC P78527 2/20 0.37
GGPS1 O95749 1/20 0.35
PTGES2 Q9H7Z7 1/20 0.33
AVPR1A P37288 1/20 0.31
MEN1 O00255 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 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
SCHEMBL25875721 0.94 ALOX5 (0.40) ALOX5PRKDCGGPS1AVPR1AMEN1
SCHEMBL25875585 0.91 HSP90AA1 (0.34) ALOX5MEN1KMT2A
SCHEMBL25876821 0.90 ALOX5 (0.42) ALOX5PRKDCGGPS1PTGES2AVPR1A
SCHEMBL25874830 0.90 ALOX5 (0.46) ALOX5PRKDCGGPS1PTGES2
SCHEMBL25875814 0.90 ALOX5 (0.31) ALOX5
SCHEMBL25875594 0.87 KDM4E (0.30)
SCHEMBL25875195 0.86 ALOX5 (0.42) ALOX5PRKDCGGPS1PTGES2
SCHEMBL25875479 0.86 ALOX5 (0.42) ALOX5PRKDCGGPS1PTGES2
SCHEMBL12324541 0.86 ALOX5 (0.57) ALOX5PRKDCGGPS1PTGES2AVPR1A
SCHEMBL25875589 0.85 PDK2 (0.37) MEN1KMT2A

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