SCHEMBL28990458

SCHEMBL28990458

CCCCC1=CCC(O)(N=Nc2ccccc2)C=C1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 5/20 0.32
OPRM1 P35372 4/20 0.32
OPRD1 P41143 4/20 0.32
OPRK1 P41145 4/20 0.32
ALPL P05186 1/20 0.32
ALPG P10696 1/20 0.32
LIPG Q9Y5X9 1/20 0.31
CES2 O00748 2/20 0.31
CES1 P23141 2/20 0.31

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
SCHEMBL28999759 0.78 OPRM1 (0.34) OPRL1OPRM1OPRD1OPRK1LIPG
SCHEMBL27750599 0.72 NPC1 (0.32) LIPG
SCHEMBL6546828 0.71 OPRM1 (0.34) OPRL1OPRM1OPRD1OPRK1
SCHEMBL6547360 0.68 LIPG (0.35) OPRL1OPRM1OPRD1OPRK1LIPG
SCHEMBL10875599 0.67 LIPG (0.36) LIPG
Azobenzene SCHEMBL28807502 0.67 ALDH1A1 (0.63) ALPLALPGCES2CES1
Azobenzene SCHEMBL28807503 0.67 ALDH1A1 (0.63) ALPLALPGCES2CES1
SCHEMBL28391789 0.67 OPRM1 (0.36) OPRL1OPRM1OPRD1OPRK1ALPL
Azobenzene SCHEMBL27937521 0.65 ALDH1A1 (0.60) ALPLALPGCES2CES1
Azobenzene SCHEMBL27918792 0.65 ALDH1A1 (0.60) ALPLALPGCES2CES1

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
CN-115995601-A Solid polymer electrolyte based on azobenzene liquid crystal polymer 北京大学 2023-04-21 CN disclosed