SCHEMBL14727965

SCHEMBL14727965

CCc1cc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACLY P53396 2/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
DCLRE1B Q9H816 1/20 0.34
RECQL P46063 1/20 0.34
SSTR5 P35346 4/20 0.34
SGK1 O00141 1/20 0.32
CAMKK2 Q96RR4 1/20 0.32
PKM P14618 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
ORAI1 Q96D31 1/20 0.31
LTB4R Q15722 2/20 0.31
LTB4R2 Q9NPC1 2/20 0.31
PTGDR2 Q9Y5Y4 2/20 0.31
NEK2 P51955 1/20 0.31

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
SCHEMBL1795774 0.91 ACLY (0.33) ACLYCA1CA2DCLRE1BRECQL
SCHEMBL28058729 0.91 PDK2 (0.34) CA1CA2DCLRE1BSSTR5SGK1
SCHEMBL3457034 0.91 ACLY (0.35) ACLYCA1CA2DCLRE1BRECQL
SCHEMBL1798784 0.91 GPR52 (0.35) CA1CA2SSTR5
SCHEMBL1801082 0.91 ACLY (0.33) ACLYCA1CA2DCLRE1BRECQL
SCHEMBL1799389 0.89 NPC1 (0.36) CA1CA2LTB4RLTB4R2
SCHEMBL12274098 0.88 RXRB (0.41) CA1CA2RECQLPKM
SCHEMBL29385555 0.88 RXRB (0.41) CA1CA2RECQLPKM
SCHEMBL362701 0.88 RXRB (0.41) CA1CA2RECQLPKM
SCHEMBL29397265 0.88 RXRB (0.41) CA1CA2RECQLPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2748155-B1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-12-20 EP disclosed
US-9247740-B2 Isoxazoline derivatives as insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-02-02 US disclosed
US-9247740-B2 Isoxazoline derivatives as insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-02-02 US disclosed
US-20140206606-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-07-24 US disclosed
US-20140206606-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-07-24 US disclosed
EP-1932836-B1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND HARMFUL ORGANISM-CONTROLLING AGENT NISSAN CHEMICAL IND LTD (JP) 2013-11-06 EP disclosed
WO-2013026931-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-02-28 WO disclosed
WO-2013026695-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-02-28 WO 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 (1 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-20140206606-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS CHRM1, CHRM3, CHRM2 ACLY 351/4885CA1 1012/4885CA2 380/4885

“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.