SCHEMBL9130820

SCHEMBL9130820

C=CCCc1cccc(Oc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.45
DAO P14920 1/20 0.45
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
HTT P42858 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FDFT1 P37268 8/20 0.44
FFAR4 Q5NUL3 1/20 0.43
MAOB P27338 1/20 0.43

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
SCHEMBL11568945 0.84 FFAR1 (0.53) FFAR1HTTSMN1; SMN2FFAR4
SCHEMBL7332622 0.83 FFAR1 (0.48) FFAR1DAOKDM4EALDH1A1HTT
SCHEMBL7806003 0.82 ALDH1A1 (0.46) FFAR1KDM4EALDH1A1HTTTDP1
SCHEMBL30083990 0.82 ALDH1A1 (0.46) FFAR1KDM4EALDH1A1HTTTDP1
SCHEMBL7915751 0.81 MAOA (0.44) FFAR1DAOKDM4EALDH1A1HTT
SCHEMBL1162041 0.81 TAAR1 (0.61)
SCHEMBL5540055 0.80 FFAR1 (0.50) FFAR1DAOKDM4EALDH1A1HTT
SCHEMBL10446473 0.80 FFAR1 (0.46) FFAR1DAOKDM4EALDH1A1HTT
SCHEMBL8973390 0.77 FDFT1 (0.50) KDM4EALDH1A1HTTSMN1; SMN2FDFT1
SCHEMBL5545164 0.77 FDFT1 (0.51) FFAR1DAOFDFT1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0004754-B1 KETOXIMINOETHER INSECTICIDES RHONE-POULENC AGROCHIMIE (FR) 1983-10-05 EP claimed
US-5466838-A Catalytic reaction of olefin with oxygen in the presence of aldehyde SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-11-14 US disclosed
EP-0540009-B1 Process for producing epoxides SUMITOMO CHEMICAL CO (JP) 1995-08-30 EP disclosed
US-5367087-A Process for producing epoxide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-11-22 US disclosed
EP-0540009-A1 Process for producing epoxides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-05-05 EP disclosed