SCHEMBL28524770

SCHEMBL28524770

OC1(c2ccc(F)cc2)CC=CC=C1c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.38
OPRD1 P41143 2/20 0.38
OPRK1 P41145 2/20 0.38
OPRL1 P41146 2/20 0.38
NPY5R Q15761 1/20 0.36
CYP2D6 P10635 1/20 0.32
MAPT P10636 2/20 0.32
CYP17A1 P05093 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP11B2 P19099 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
HSD11B1 P28845 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
DRD2 P14416 1/20 0.32

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 0.89 HDAC1 (0.34) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL28542503 0.81 HSD11B1 (0.34) OPRM1OPRL1MAPTHSD11B1
SCHEMBL28527751 0.81 OPRM1 (0.43) OPRM1OPRD1OPRK1OPRL1MAPT
SCHEMBL28531370 0.79 NPY5R (0.36) OPRM1OPRD1OPRK1OPRL1NPY5R
SCHEMBL30721713 0.76 OPRM1 (0.35) OPRM1OPRD1OPRK1OPRL1CYP11B2
SCHEMBL7853755 0.75 KDM4E (0.35) MAPTKDM4EMEN1ALDH1A1HPGD
SCHEMBL365627 0.73 ESR1 (0.32) ALDH1A1
Methane SCHEMBL28012238 0.72 ESR1 (0.31)
SCHEMBL28598865 0.72 OPRM1 (0.39) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL29402707 0.71 HPGD (0.36) ALDH1A1HPGDHTT

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