SCHEMBL9558474

SCHEMBL9558474

COc1ccc(C(C(=O)OCc2cccc(Oc3ccccc3)c2)C(C)C)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
FFAR1 O14842 5/20 0.46
MMP1 P03956 2/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
HDAC8 Q9BY41 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP12 P39900 1/20 0.44
PRKCI P41743 1/20 0.44
PRKCZ Q05513 1/20 0.44
KCNH2 Q12809 1/20 0.44
PDE10A Q9Y233 1/20 0.43
PTGES O14684 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
FKBP1A P62942 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
SCHEMBL9558462 0.89 ALDH1A1 (0.52) ACHECA1CA2FFAR1MMP1
SCHEMBL11192400 0.87 PTGS1 (0.52) FFAR1MMP1FFAR4MMP2MMP9
SCHEMBL11551340 0.85 FFAR1 (0.48) FFAR1MMP1FFAR4MMP2MMP9
SCHEMBL11444616 0.84 FFAR1 (0.47) FFAR1MMP1FFAR4MMP2MMP9
SCHEMBL8935419 0.84 LMNA (0.54) FFAR1MMP1PPARGPPARAFFAR4
SCHEMBL11791207 0.84 FFAR1 (0.47) FFAR1MMP1FFAR4MMP2MMP9
SCHEMBL9559014 0.84 MMP1 (0.45) ACHECA1CA2FFAR1MMP1
SCHEMBL11444636 0.82 ADRB3 (0.49) FFAR1MMP1PPARGPPARAMMP2
SCHEMBL11444839 0.81 FFAR1 (0.41) FFAR1MMP1PPARGPPARAFFAR4
SCHEMBL11444569 0.81 FFAR1 (0.41) FFAR1MMP1FFAR4MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0257415-B1 INSECTICIDAL RESIN COATING FILM MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-03-31 EP disclosed
US-4997650-A (Meth)acrylonitrile polymer MITSUI TOATSU CHEMICALS, INC. (JP) 1991-03-05 US disclosed
US-4818525-A LONG-LASTING; ACRYLONITRILE COPOLYMER MITSUI TOATSU CHEMICALS, INC. (JP) 1989-04-04 US disclosed
EP-0257415-A1 Insecticidal resin coating film MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-03-02 EP disclosed
US-4611009-A Combating arthropods with 3-phenoxybenzyl 2,2-dimethyl-3-vinylcyclopropane carboxylates BAYER AKTIENGESELLSCHAFT (DE) 1986-09-09 US disclosed
EP-0001064-B1 FLUOROSUBSTITUTED PHENOXYBENZYL-OXYCARBONYLDERIVATIVES, -ALCOHOLS AND -HALIDES, PROCESSES FOR THEIR PREPARATION AND THEIR APPLICATION BAYER AG (DE) 1982-07-07 EP disclosed
US-4276306-A INSECTICIDES, MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-06-30 US disclosed
US-4261920-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-04-14 US disclosed
EP-0000345-B1 SUBSTITUTED PHENOXYBENZYLOXYCARBONYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES AND ACARICIDES BAYER AG (DE) 1981-04-01 EP disclosed
US-4218469-A Combating arthropods with 3-phenoxy-fluoro-benzyl carboxylic acid esters BAYER AKTIENGESELLSCHAFT (DE) 1980-08-19 US disclosed
US-4199596-A ESTERS, INSECTICIDES, MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-04-22 US disclosed
EP-0001064-A2 Fluorosubstituted phenoxybenzyl-oxycarbonylderivatives, -alcohols and -halides, processes for their preparation and their application BAYER AG (DE) 1979-03-21 EP disclosed
EP-0000345-A1 Substituted phenoxybenzyloxycarbonyl derivatives, their preparation and their use as insecticides and acaricides BAYER AG (DE) 1979-01-24 EP disclosed