SCHEMBL26104235

SCHEMBL26104235

CCC(=O)OC1(c2ccc(O)cc2)CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 4/20 0.46
▸ OPRD1 P41143 3/20 0.46
▸ OPRK1 P41145 3/20 0.46
▸ ESR1 P03372 3/20 0.44
▸ ESR2 Q92731 3/20 0.44
▸ DRD3 P35462 2/20 0.43
▸ DRD2 P14416 1/20 0.41
▸ DRD4 P21917 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA7 P43166 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ CA14 Q9ULX7 1/20 0.34

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
SCHEMBL22790441 0.86 OPRM1 (0.60) OPRM1OPRD1OPRK1DRD3LMNA
SCHEMBL3554785 0.84 DRD3 (0.54) OPRM1OPRD1OPRK1DRD3DRD2
SCHEMBL26059382 0.82 ESR2 (0.48) OPRM1ESR1ESR2DRD3DRD2
SCHEMBL26059374 0.80 ESR2 (0.47) ESR1ESR2DRD3DRD2DRD4
SCHEMBL25468013 0.78 ADORA3 (0.39) OPRM1OPRD1OPRK1ESR1ESR2
SCHEMBL28398971 0.77 OPRM1 (0.65) OPRM1OPRD1OPRK1DRD3DRD2
SCHEMBL290859 0.76 CYP19A1 (0.40) OPRM1OPRD1OPRK1DRD3ADORA3
SCHEMBL25698983 0.75 ESR2 (0.42) ESR1ESR2LMNAMEN1KMT2A
SCHEMBL25348323 0.71 OPRM1 (0.45) OPRM1OPRD1OPRK1DRD3LMNA
SCHEMBL11709399 0.71 OPRM1 (0.58) OPRM1OPRD1OPRK1DRD3DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106497023-A A kind of anti-shrinkage citicall limited aluminium film 无锡三帝特种高分子材料有限公司 2017-03-15 — — CN claimed
WO-2023074830-A1 AROMATIC POLYCARBONATE RESIN, POLYCARBONATE RESIN COMPOSITION AND MOLDED ARTICLE 出光興産株式会社 2023-05-04 — — WO disclosed
CN-106497023-A A kind of anti-shrinkage citicall limited aluminium film 无锡三帝特种高分子材料有限公司 2017-03-15 — — CN disclosed
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