SCHEMBL7797833

SCHEMBL7797833

O=C(NCc1ccccc1)NC(Cc1ccccc1)C1CC(Cc2ccccc2)=NO1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.45
ATM Q13315 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM1A O60341 1/20 0.40
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
HPGD P15428 2/20 0.39
EPHX1 P07099 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL7796582 0.95 ALDH1A1 (0.46) ANPEPATML3MBTL1MAPTALDH1A1
SCHEMBL8432613 0.91 RECQL (0.44) L3MBTL1ALDH1A1HPGDUSP2LMNA
SCHEMBL7799010 0.90 POLB (0.37) ANPEPATML3MBTL1MAPTALDH1A1
SCHEMBL7789577 0.89 CYP1A2 (0.47) MAPTALDH1A1HPGD
SCHEMBL7799091 0.88 NPC1 (0.40) L3MBTL1ITGB3ITGA2BLMNA
SCHEMBL7796446 0.88 POLB (0.48) L3MBTL1ITGB3LMNA
SCHEMBL7797839 0.86 NPC1 (0.44) LMNA
SCHEMBL8175076 0.86 FPR2 (0.41)
SCHEMBL8178600 0.86 CTRB1 (0.42) L3MBTL1MAPTALDH1A1LMNA
SCHEMBL7789521 0.86 CTRB1 (0.42) L3MBTL1MAPTALDH1A1LMNA

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 5 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-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