SCHEMBL6745680

SCHEMBL6745680

O=C(Oc1ccc(CCCCc2ccccc2)cc1)Oc1ccc(CCCCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.58
MAPT P10636 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
PPARG P37231 1/20 0.53
PPARA Q07869 1/20 0.53
HDAC1 Q13547 4/20 0.52
HDAC3 O15379 1/20 0.52
MAPK1 P28482 1/20 0.52
ADRA1A P35348 1/20 0.52
HDAC4 P56524 1/20 0.52
SLC6A3 Q01959 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
HDAC5 Q9UQL6 1/20 0.52

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
SCHEMBL248390 0.88 THRB (0.63) MAPTPPARGPPARAFAAHTHRB
SCHEMBL249214 0.87 THRB (0.62) MAPTPPARGPPARASLC6A3FAAH
SCHEMBL5166821 0.87 THRB (0.62) MAPTPPARGPPARASLC6A3FAAH
SCHEMBL5165582 0.87 THRB (0.62) MAPTPPARGPPARASLC6A3FAAH
SCHEMBL247206 0.87 THRB (0.62) MAPTPPARGPPARASLC6A3FAAH
SCHEMBL247374 0.86 THRB (0.56) FFAR1FAAHTHRB
SCHEMBL8565931 0.85 NPC1 (0.61) FFAR1MAPTRXFP1PPARGPPARA
SCHEMBL28552240 0.85 CYP4A11 (0.54) FFAR1PPARAMAPK1SMN1; SMN2LTA4H
SCHEMBL17473035 0.84 RARB (0.59) MAPTHDAC1HDAC2THRBKMT2A
SCHEMBL5478152 0.84 LTA4H (0.55) PPARGPPARAMAPK1LTA4H

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
US-6762250-B2 TRANSPARENCY, FLUIDITY; CONTAINING POLYSILOXANE HAVING AT LEAST AROMATIC HYDROCARBON FUNCTIONALITY, CARBOXYLIC ACID ESTER AND/OR ETHER LINKAGES AND PHOSPHORIC ESTER GROUP ATTACHMENT MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2004-07-13 US disclosed
US-20040054116-A1 Polycarbonate resin composition MITSUBISHI ENGINEERING-PLASTICS CORPORATION 2004-03-18 US disclosed