SCHEMBL7799007

SCHEMBL7799007

CC(C)S(=O)(=O)NC(Cc1ccccc1)C1CC(Cc2ccccc2)=NO1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 1/20 0.34
GRIA4 P48058 2/20 0.33
TAAR1 Q96RJ0 2/20 0.33
SIGMAR1 Q99720 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SLC18A2 Q05940 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
AADAT Q8N5Z0 1/20 0.31
LMTK3 Q96Q04 1/20 0.31
MMP2 P08253 3/20 0.30
MMP9 P14780 2/20 0.30

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
SCHEMBL7797907 0.88 SORT1 (0.35) SORT1TAAR1SIGMAR1NPC1RAB9A
SCHEMBL7796459 0.87 SORT1 (0.35) SORT1TAAR1NPC1RAB9AALDH1A1
SCHEMBL7800186 0.87 MMP2 (0.41) ALDH1A1MAPTLMTK3MMP2MMP9
SCHEMBL7800178 0.85 ALDH1A1 (0.36) SORT1ALDH1A1MMP2MMP9
SCHEMBL7789584 0.84 PSEN1 (0.34) SORT1ALDH1A1MAPT
SCHEMBL7800253 0.84 CA2 (0.48) ALDH1A1MAPTMMP2MMP9
SCHEMBL7799021 0.83 SORT1 (0.40) SORT1TAAR1SIGMAR1NPC1RAB9A
SCHEMBL7796591 0.82 SIGMAR1 (0.36) SORT1TAAR1SIGMAR1NPC1RAB9A
SCHEMBL7800100 0.82 ALDH1A1 (0.37) ALDH1A1MAPT
SCHEMBL7797834 0.81 MMP2 (0.49) ALDH1A1MMP2MMP9

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