SCHEMBL8915090

SCHEMBL8915090

C=CCOCCOc1ccc(C(=O)Oc2ccc(C(=O)OCC(C)CC)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.51
▸ ADRB2 P07550 3/20 0.47
▸ ADRB1 P08588 3/20 0.47
▸ ADRB3 P13945 3/20 0.47
▸ PRSS1 P07477 1/20 0.41
▸ ACR P10323 1/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ KMT2A Q03164 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 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
SCHEMBL8916551 0.99 MAPT (0.50) MAPTADRB2ADRB1ADRB3PRSS1
SCHEMBL8917111 0.99 MAPT (0.50) MAPTADRB2ADRB1ADRB3PRSS1
SCHEMBL8917108 0.99 MAPT (0.50) MAPTADRB2ADRB1ADRB3PRSS1
SCHEMBL8916541 0.99 MAPT (0.50) MAPTADRB2ADRB1ADRB3PRSS1
SCHEMBL9506063 0.94 MAPT (0.49) MAPTADRB2ADRB1ADRB3PRSS1
SCHEMBL10464053 0.91 MAPT (0.46) MAPTADRB2ADRB1ADRB3PRSS1
SCHEMBL8917247 0.90 ADRB2 (0.58) MAPTADRB2ADRB1ADRB3PRSS1
SCHEMBL8915082 0.90 ADRB2 (0.58) MAPTADRB2ADRB1ADRB3PRSS1
SCHEMBL9503752 0.87 MAPT (0.49) MAPTADRB2ADRB1ADRB3NPC1
SCHEMBL8916152 0.87 MAPT (0.56) MAPTADRB2ADRB1ADRB3TDP1

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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