SCHEMBL7797932

SCHEMBL7797932

CCOC(=O)NC(Cc1ccccc1)C1CC(Cc2ccccc2)=NO1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.39
TGM2 P21980 1/20 0.38
ITGB3 P05106 5/20 0.38
ITGAV P06756 4/20 0.38
F2 P00734 1/20 0.37
PLG P00747 1/20 0.37
PLAU P00749 1/20 0.37
PLAT P00750 1/20 0.37
MLYCD O95822 1/20 0.37
ITGA2B P08514 2/20 0.37
TSHR P16473 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL7800176 0.92 TGM2 (0.37) TGM2ITGB3ITGAVMLYCDITGA2B
SCHEMBL7796404 0.90 TGM2 (0.47) TGM2ITGB3ITGAVITGA2BTSHR
SCHEMBL8182503 0.90 TGM2 (0.47) TGM2ITGB3ITGAVITGA2BTSHR
SCHEMBL7797836 0.90 NPC1 (0.38) TGM2ITGB3ITGAVMLYCDTSHR
SCHEMBL8178968 0.90 NPC1 (0.38) TGM2ITGB3ITGAVMLYCDTSHR
SCHEMBL7797923 0.90 KDM4E (0.43) TGM2ITGB3ITGAVMLYCDITGA2B
SCHEMBL7800262 0.89 CTSL (0.46) TGM2ITGB3ITGAVITGA2BTSHR
SCHEMBL7797842 0.87 NPC1 (0.39) TGM2ITGB3ITGAVMLYCDITGA2B
SCHEMBL7789557 0.87 ATM (0.47) MLYCDTSHRLMNASMN1; SMN2ATM
SCHEMBL8175419 0.87 ATM (0.47) MLYCDTSHRLMNASMN1; SMN2ATM

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