SCHEMBL7797845

SCHEMBL7797845

C=CC(Cc1ccccc1)NC(=O)Oc1ccc(C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
PSMB8 P28062 1/20 0.44
PSMB5 P28074 1/20 0.44
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
BCHE P06276 4/20 0.41
ACHE P22303 4/20 0.41
ITGB1 P05556 1/20 0.41
ITGA4 P13612 1/20 0.41
ITGB7 P26010 1/20 0.41
GAA P10253 2/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CTSK P43235 4/20 0.41
CTSL P07711 2/20 0.41

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
SCHEMBL7797860 0.91 SLC1A3 (0.46) PSMB5BCHEACHEITGB1ITGA4
SCHEMBL7796554 0.90 GAA (0.53) PPARGPPARACNR2ALDH1A1ACHE
SCHEMBL7797822 0.84 CTSL (0.53) ALDH1A1GAACTSKCTSLCTSB
SCHEMBL7796626 0.83 MEN1 (0.50) ALDH1A1RAB9ANPC1CTSLLMNA
SCHEMBL7796647 0.82 CTSK (0.47) ALDH1A1ATMRAB9ANPC1TAAR1
SCHEMBL7800081 0.81 MMP8 (0.49) ATMGAACTSKCTSLCTSB
SCHEMBL7796452 0.80 NPC1 (0.50) RAB9ANPC1LMNAHTT
SCHEMBL7626858 0.79 CTRB1 (0.50) PSMB8PSMB5RAB9ANPC1TAAR1
SCHEMBL3554246 0.79 CTRB1 (0.50) PSMB8PSMB5RAB9ANPC1TAAR1
SCHEMBL7800119 0.79 CTSK (0.53) RAB9ANPC1TAAR1CTSKCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748801-B1 2-ISOXAZOLINE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING RELATED DERIVATIVES FROM THE SAME DAICEL CHEM (JP) 2001-12-19 EP disclosed
US-6018069-A 2-isoxazoline derivative and process for producing the same and process for producing related derivatives from the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-01-25 US disclosed
US-5994558-A 2-isoxazoline derivative and process for producing the same; and process for producing related derivatives from the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-30 US disclosed
US-5962692-A 2-isoxazoline derivative and process for producing the same, and process for producing related derivatives from the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-05 US disclosed
US-5750717-A 2-isoxazoline derivative and process for producing the same, and process for producing related derivatives from the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-05-12 US disclosed
EP-0748801-A1 2-ISOXAZOLINE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING RELATED DERIVATIVES FROM THE SAME DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-18 EP disclosed