SCHEMBL8967142

SCHEMBL8967142

COc1ccc(C(N)CO)cc1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CASR P41180 3/20 0.45
TPH1 P17752 2/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
CFD P00746 2/20 0.42
F11 P03951 2/20 0.42
TPSB2 P20231 2/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
EGFR P00533 1/20 0.41
CTSA P10619 5/20 0.40
CD274 Q9NZQ7 3/20 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
SCHEMBL20545890 0.86 CTSA (0.50) TPH1CTSA
SCHEMBL20545888 0.86 CTSA (0.50) TPH1CTSA
SCHEMBL28372548 0.81 CTSA (0.43) TPH1CTSA
SCHEMBL30541542 0.81 CTSA (0.43) TPH1CTSA
SCHEMBL5465903 0.80 PPARG (0.62) PPARGPPARDPPARA
SCHEMBL1966508 0.80 PPARG (0.62) PPARGPPARDPPARA
SCHEMBL9330888 0.80 PPARG (0.62) PPARGPPARDPPARA
Hydrochloric Acid SCHEMBL11337249 0.79 PPARG (0.60) PPARGPPARDPPARA
SCHEMBL11951612 0.79 CASR (0.53) CASRMAOAMAOBCTSA
SCHEMBL9524187 0.78 GAA (0.49) PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1040939-C Alpha-substituted phenyl-2-oxazoline or thiazoline derivatives, process for producing same and insecticides and acaricides containing same YASHIMA CHEMICAL INDUSTRY INC (JP) 1998-12-02 CN disclosed
EP-0432661-B1 2-Substituted phenyl-2-oxazoline or thiazoline derivatives, process for producing the same and insecticides and acaricides containing the same YASHIMA KAGAKU KOGYO KK (JP) 1996-03-06 EP disclosed
US-5141948-A 2-SUBSTITUTED PHENYL-2-OXAZOLINE OR THIAZOLINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND INSECTICIDES AND ACARICIDES CONTAINING THE SAME YASHIMA CHEMICAL INDUSTRIAL CO., LTD. (JP) 1992-08-25 US disclosed
EP-0432661-A2 2-Substituted phenyl-2-oxazoline or thiazoline derivatives, process for producing the same and insecticides and acaricides containing the same YASHIMA CHEMICAL INDUSTRIAL CO., LTD. (JP) 1991-06-19 EP disclosed