Sugi Predict

Sugi Predict / Compounds / SCHEMBL7227600

SCHEMBL7227600

SCHEMBL7227600

CC(Oc1ccc(COc2cc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c(F)cc2Cl)cc1Cl)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 7/20 0.39
▸ PPARG P37231 4/20 0.39
▸ PPARD Q03181 2/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ DHODH Q02127 3/20 0.36
▸ FFAR1 O14842 1/20 0.36
▸ PPOX P50336 3/20 0.35
▸ S1PR1 P21453 1/20 0.35
▸ S1PR5 Q9H228 1/20 0.35

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
SCHEMBL7220894 0.94 TSHR (0.38) MRGPRX4PPARGPPARDPPARAFFAR1
SCHEMBL7227776 0.94 PPARG (0.39) MRGPRX4PPARGPPARDPPARAPPOX
SCHEMBL7219964 0.94 PPARG (0.45) MRGPRX4PPARGPPOX
SCHEMBL7226396 0.94 PPARG (0.38) MRGPRX4PPARGPPARDPPARAFFAR1
SCHEMBL7227955 0.93 PPARG (0.39) MRGPRX4PPARGPPARDPPARADHODH
SCHEMBL7225862 0.92 PPARG (0.37) MRGPRX4PPARGPPARDPPARADHODH
SCHEMBL7227640 0.90 MRGPRX4 (0.39) MRGPRX4PPARGPPARADHODHPPOX
SCHEMBL7220014 0.90 PPARG (0.38) PPARGDHODHPPOX
SCHEMBL7227525 0.89 PPARG (0.36) PPARGDHODHPPOX
SCHEMBL7719036 0.88 PPOX (0.40) PPARGDHODHPPOX

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
US-6664214-B1 Uracil compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-16 — — US disclosed