SCHEMBL1799259

SCHEMBL1799259

COC(=O)NC(=O)c1ccc(C=O)cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.45
HPGD P15428 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
AOX1 Q06278 1/20 0.39
TRIM24 O15164 1/20 0.39
ALDH5A1 P51649 1/20 0.39
ABAT P80404 1/20 0.39
TRIM33 Q9UPN9 1/20 0.39
TSHR P16473 1/20 0.39
SRC P12931 1/20 0.38
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP1A2 P05177 1/20 0.38
HSP90AA1 P07900 1/20 0.38
CYP2C19 P33261 1/20 0.38
LMNA P02545 1/20 0.37
ALDH1A3 P47895 2/20 0.36
STAT3 P40763 1/20 0.36
KMT2A Q03164 2/20 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
SCHEMBL1796296 0.84 LMNA (0.41) ALDH1A1HPGDMAPTSMN1; SMN2CYP2C9
SCHEMBL1796295 0.84 LMNA (0.41) ALDH1A1HPGDMAPTSMN1; SMN2CYP2C9
SCHEMBL25248337 0.80 HDAC1 (0.42) ALDH1A1SRCALDH1A3KDM4ERAB9A
SCHEMBL497789 0.80 ALDH1A1 (0.59) ALDH1A1HPGDTDP1AOX1TRIM24
SCHEMBL1800343 0.77 ALDH1A1 (0.41) ALDH1A1HPGDTDP1AOX1TRIM24
SCHEMBL9849593 0.75 L3MBTL1 (0.52) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL102841 0.74 ALDH1A1 (0.52) ALDH1A1TRIM24TRIM33CYP2C9ALDH1A3
SCHEMBL14136482 0.74 ALDH1A1 (0.43) ALDH1A1HPGDTDP1AOX1TRIM24
SCHEMBL28835335 0.73 ALDH1A1 (0.42) ALDH1A1HPGDTDP1AOX1TRIM24
SCHEMBL1800318 0.73 PARP10 (0.44) ALDH1A1HPGDTDP1AOX1TRIM24

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
US-8987464-B2 Isoxazoline-substituted benzamide compound and pesticide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-03-24 US disclosed
US-20140135496-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-05-15 US disclosed
US-8673951-B2 Isoxazoline-substituted benzamide compound and pesticide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-03-18 US disclosed
US-20110144334-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-06-16 US disclosed
US-7951828-B1 Isoxazoline-substituted benzamide compound and pesticide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-05-31 US disclosed
EP-1932836-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND HARMFUL ORGANISM-CONTROLLING AGENT Nissan Chemical Industries, Ltd. (JP) 2008-06-18 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110144334-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE OR10J3, OR51E2, ORMDL3 ALDH1A1 475/4885HPGD 3450/4885TDP1 3656/4885
US-20140135496-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE OR10J3, OR51E2, ODC1 ALDH1A1 988/4885HPGD 3906/4885TDP1 1862/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.