SCHEMBL25844151

SCHEMBL25844151

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

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.31
TP53 P04637 1/20 0.31
KDM4E B2RXH2 2/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ACHE P22303 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 1/20 0.31
IDO1 P14902 2/20 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
SCHEMBL25844011 0.99 TP53 (0.32) MAPTTP53KDM4ELMNAMEN1
SCHEMBL25844009 0.97 TP53 (0.34) MAPTTP53KDM4ELMNAMEN1
SCHEMBL25844185 0.95 GPR84 (0.34) MAPTTP53KDM4ELMNAMEN1
SCHEMBL25844182 0.95 GPR84 (0.34) MAPTTP53KDM4ELMNAMEN1
SCHEMBL25844048 0.95
SCHEMBL25844013 0.95 LTA4H (0.32) MAPTTP53KDM4EALDH1A1HTT
SCHEMBL25844033 0.94 GPR84 (0.31)
SCHEMBL25836099 0.93 KDM4E (0.31) MAPTKDM4ELMNAMEN1ALDH1A1
SCHEMBL26640341 0.93 KDM4E (0.31) KDM4ELMNAMEN1ALDH1A1CYP2C9
SCHEMBL25844384 0.92 PGR (0.32) KDM4ELMNAMEN1ALDH1A1CYP2C9

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