SCHEMBL25844013

SCHEMBL25844013

COc1ccc(C2(c3ccc(Oc4ccccc4)cc3)C=Cc3c4c(c5ccccc5c3O2)-c2ccc(C)cc2C4(C)C)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.32
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL25844017 0.96
SCHEMBL25844012 0.95
SCHEMBL25844009 0.95 TP53 (0.34) TP53MAPTGPR84KDM4EALDH1A1
SCHEMBL25844011 0.95 TP53 (0.32) TP53MAPTGPR84KDM4EALDH1A1
SCHEMBL25844151 0.95 MAPT (0.31) TP53MAPTKDM4EALDH1A1HTT
SCHEMBL25844182 0.94 GPR84 (0.34) TP53MAPTGPR84KDM4EALDH1A1
SCHEMBL25844185 0.94 GPR84 (0.34) TP53MAPTGPR84KDM4EALDH1A1
SCHEMBL26646591 0.93
SCHEMBL25844048 0.91
SCHEMBL25844358 0.90 LTA4H (0.35) LTA4HGPR84KDM4EALDH1A1HTT

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
US-20230227717-A1 PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND SPECTACLES HOYA LENS THAILAND LTD. (TH) 2023-07-20 US disclosed