SCHEMBL28527751

SCHEMBL28527751

COc1ccc(C2(O)CC=CC=C2c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.43
OPRL1 P41146 5/20 0.43
OPRD1 P41143 2/20 0.42
OPRK1 P41145 2/20 0.42
ALDH1A1 P00352 3/20 0.40
LMNA P02545 3/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
EDNRA P25101 1/20 0.38
BACE1 P56817 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
CYP3A4 P08684 1/20 0.36
GLA P06280 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL9704268 0.85 HDAC1 (0.34) OPRM1OPRL1OPRD1OPRK1ALDH1A1
SCHEMBL28524770 0.81 OPRM1 (0.38) OPRM1OPRL1OPRD1OPRK1ALDH1A1
SCHEMBL28542503 0.81 HSD11B1 (0.34) OPRM1OPRL1LMNATDP1L3MBTL1
SCHEMBL28538548 0.81 OPRM1 (0.43) OPRM1OPRL1OPRD1OPRK1ALDH1A1
SCHEMBL30721718 0.75 OPRM1 (0.39) OPRM1OPRL1OPRD1OPRK1ALDH1A1
SCHEMBL28389806 0.75 OPRM1 (0.37) OPRM1OPRL1ALDH1A1LMNAKDM4E
SCHEMBL27874345 0.73 HK2 (0.30)
SCHEMBL7853755 0.72 KDM4E (0.35) ALDH1A1KMT2AMEN1KDM4ETDP1
SCHEMBL28959600 0.71 TRPA1 (0.45) ALDH1A1LMNAKMT2AMEN1KDM4E
SCHEMBL27712623 0.71 TRPA1 (0.31) OPRM1OPRL1OPRK1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112513051-B Compound and color conversion film comprising the same 株式会社LG化学 2023-12-26 CN disclosed
CN-112513051-A Compound and color conversion film comprising same 株式会社LG化学 2021-03-16 CN disclosed