SCHEMBL8915031

SCHEMBL8915031

C=CCOc1ccc(C(=O)O)cc1.CCC(C)COC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.62
▸ ADRB2 P07550 2/20 0.51
▸ ADRB1 P08588 2/20 0.51
▸ ADRB3 P13945 2/20 0.51
▸ SLC1A5 Q15758 1/20 0.44
▸ RARB P10826 5/20 0.43
▸ SRD5A2 P31213 1/20 0.43
▸ FFAR1 O14842 1/20 0.41
▸ RXRA P19793 1/20 0.41
▸ RXRB P28702 1/20 0.41
▸ PPARG P37231 3/20 0.41
▸ PPARD Q03181 3/20 0.41
▸ PPARA Q07869 3/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PDCD1 Q15116 1/20 0.40

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
SCHEMBL8916152 0.91 MAPT (0.56) MAPTADRB2ADRB1ADRB3SLC1A5
SCHEMBL8917296 0.90 MAPT (0.55) MAPTADRB2ADRB1ADRB3SLC1A5
SCHEMBL8916751 0.90 MAPT (0.55) MAPTADRB2ADRB1ADRB3SLC1A5
SCHEMBL9412131 0.89 ADRB2 (0.55) MAPTADRB2ADRB1ADRB3NPC1
SCHEMBL10576384 0.89 ADRB2 (0.55) MAPTADRB2ADRB1ADRB3NPC1
SCHEMBL10577524 0.89 ADRB2 (0.55) MAPTADRB2ADRB1ADRB3NPC1
SCHEMBL10576380 0.89 ADRB2 (0.55) MAPTADRB2ADRB1ADRB3NPC1
SCHEMBL8917247 0.85 ADRB2 (0.58) MAPTADRB2ADRB1ADRB3NPC1
SCHEMBL8915082 0.85 ADRB2 (0.58) MAPTADRB2ADRB1ADRB3NPC1
SCHEMBL5959979 0.82 MAPT (0.74) MAPTADRB2ADRB1ADRB3SLC1A5

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-5656197-A Ferroelectric liquid crystal NATIONAL SCIENCE COUNCIL (TW) 1997-08-12 — — US disclosed
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