SCHEMBL11204692

SCHEMBL11204692

COC(=O)CS(=O)(=O)Cc1cccc(Oc2ccc(C(F)(F)F)cc2Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 12/20 0.49
FFAR1 O14842 2/20 0.47
PPARG P37231 1/20 0.45
PPARD Q03181 1/20 0.45
PPARA Q07869 1/20 0.45
P2RX4 Q99571 1/20 0.44
KCNQ3 O43525 1/20 0.44
KCNQ2 O43526 1/20 0.44
STK39 Q9UEW8 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
SCHEMBL10692331 0.82 MRGPRX4 (0.56) MRGPRX4FFAR1
SCHEMBL11205584 0.82 MRGPRX4 (0.51) MRGPRX4FFAR1PPARGPPARDPPARA
SCHEMBL10507759 0.81 MRGPRX4 (0.50) MRGPRX4FFAR1PPARGPPARDPPARA
SCHEMBL10507700 0.77 FFAR1 (0.62) MRGPRX4FFAR1PPARGPPARDPPARA
SCHEMBL10507578 0.77 FFAR1 (0.56) MRGPRX4FFAR1PPARGPPARDPPARA
SCHEMBL10509965 0.77 FFAR1 (0.51) MRGPRX4FFAR1PPARGPPARDPPARA
SCHEMBL10688351 0.77 FFAR1 (0.54) MRGPRX4FFAR1STK39
SCHEMBL10510999 0.77 FFAR1 (0.48) MRGPRX4FFAR1PPARGPPARDPPARA
SCHEMBL10509502 0.76 MRGPRX4 (0.57) MRGPRX4FFAR1PPARGPPARDPPARA
SCHEMBL3523039 0.76 FFAR1 (0.77) MRGPRX4FFAR1PPARGPPARDPPARA

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
EP-0077961-A2 Substituted 2-nitro-5-(4-trifluoromethyl-phenoxy) toluols, process for their preparation and their use as herbicides and plant growth regulators BAYER AG (DE) 1983-05-04 EP disclosed