SCHEMBL4040995

SCHEMBL4040995

CC(O)COc1ccc(Oc2cccc(F)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.57
USP2 O75604 1/20 0.45
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
FFAR4 Q5NUL3 3/20 0.43
FFAR1 O14842 2/20 0.43
MGLL Q99685 1/20 0.42
MMP2 P08253 1/20 0.41
MMP3 P08254 1/20 0.41
MMP9 P14780 1/20 0.41
MMP14 P50281 1/20 0.41
KDM4E B2RXH2 2/20 0.40
CETP P11597 1/20 0.40
ALOX5 P09917 1/20 0.40
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAOB P27338 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
SCHEMBL4042859 0.87 USP2 (0.50) LMNAUSP2FFAR4FFAR1MMP2
SCHEMBL4040218 0.86 LMNA (0.53) LMNAFFAR4MAOB
SCHEMBL4045199 0.84 LMNA (0.58) LMNA
SCHEMBL4050984 0.83 LMNA (0.59) LMNAHTR1DHTR1BFFAR1TDP1
SCHEMBL4045516 0.83 LMNA (0.59) LMNAHTR1DHTR1BFFAR4FFAR1
SCHEMBL1496544 0.82 LMNA (0.85) LMNAHTR1DHTR1B
SCHEMBL9713476 0.82 LMNA (0.85) LMNAHTR1DHTR1B
SCHEMBL4046461 0.82 LMNA (0.85) LMNAHTR1DHTR1B
SCHEMBL4047062 0.79 GCK (0.43) USP2HTR1DHTR1BFFAR4FFAR1
SCHEMBL10875218 0.79 MAOB (0.46) HTR1DHTR1BFFAR4FFAR1MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1380342-B1 COMPLEX CATALYST, PROCESS FOR PRODUCING THE COMPLEX CATALYST, AND PROCESS FOR PRODUCING ALCOHOL DERIVATIVE WITH THE COMPLEX CATALYST SUMITOMO CHEMICAL CO (JP) 2009-07-01 EP disclosed
US-6995110-B2 Complex catalyst, process for producing the complex catalyst, and process for producing alcohol derivative with the complex catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-02-07 US disclosed
US-20040077487-A1 Complex catalyst, process for producing the complex catalyst, and process for producing alchohol derivative with the complex catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-04-22 US disclosed
EP-1380342-A1 COMPLEX CATALYST, PROCESS FOR PRODUCING THE COMPLEX CATALYST, AND PROCESS FOR PRODUCING ALCOHOL DERIVATIVE WITH THE COMPLEX CATALYST SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2004-01-14 EP disclosed
US-4625048-A PESTICIDES HOFFMANN-LA ROCHE INC. (US) 1986-11-25 US disclosed
EP-0072475-B1 CARBAMIC ESTERS, PREPARATION THEREOF, PESTICIDAL COMPOSITIONS ON THE BASIS OF THESE COMPOUNDS AND THEIR USE IN COMBATING PESTS F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-08-20 EP disclosed
EP-0072475-A2 Carbamic esters, preparation thereof, pesticidal compositions on the basis of these compounds and their use in combating pests F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1983-02-23 EP disclosed