SCHEMBL16243447

SCHEMBL16243447

Cc1cc(C2=NO[C@@](c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 8/20 0.38
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PDK2 Q15119 2/20 0.33
SSTR5 P35346 1/20 0.32
APAF1 O14727 1/20 0.31
POLB P06746 1/20 0.31
PABPC1 P11940 1/20 0.31
GRK2 P25098 1/20 0.31
RECQL P46063 1/20 0.31
MCL1 Q07820 1/20 0.31
EIF4H Q15056 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CASP1 P29466 1/20 0.31
KDM4E B2RXH2 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
PDE4D Q08499 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
SCHEMBL738956 1.00 GPR52 (0.38) GPR52MKNK1MKNK2CA1CA2
SCHEMBL30821160 0.93 GPR52 (0.40) GPR52MKNK1MKNK2CA1CA2
SCHEMBL30309306 0.91 MKNK1 (0.36) GPR52MKNK1MKNK2CA1CA2
SCHEMBL20492267 0.91 MKNK1 (0.36) GPR52MKNK1MKNK2CA1CA2
SCHEMBL363527 0.91 CA1 (0.35) CA1CA2RECQLKDM4ERXRA
SCHEMBL20261758 0.91 CA1 (0.35) CA1CA2RECQLKDM4ERXRA
SCHEMBL362701 0.91 RXRB (0.41) CA1CA2PDK2RECQLKDM4E
SCHEMBL1694737 0.91 CA1 (0.35) CA1CA2APAF1POLBPABPC1
SCHEMBL2014009 0.91 RXRB (0.41) CA1CA2PDK2RECQLKDM4E
SCHEMBL12274098 0.91 RXRB (0.41) CA1CA2PDK2RECQLKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10588317-B2 Isoxazoline-substituted benzamides and analogues as insecticides SYNGENTA PARTICIPATIONS AG (CH) 2020-03-17 US disclosed
US-20180255780-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDES AND ANALOGUES AS INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2018-09-13 US disclosed
US-9126995-B2 Method for catalytic asymmetric synthesis of optically active isoxazoline compound and optically active isoxazoline compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-09-08 US disclosed
US-20140350261-A1 METHOD FOR CATALYTIC ASYMMETRIC SYNTHESIS OF OPTICALLY ACTIVE ISOXAZOLINE COMPOUND, AND OPTICALLY ACTIVE ISOXAZOLINE COMPOUND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-11-27 US 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 (3 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-20180255780-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDES AND ANALOGUES AS INSECTICIDES ACHE, CHRM1, NIT2 GPR52 1660/4885MKNK1 2653/4885MKNK2 2026/4885
US-10588317-B2 Isoxazoline-substituted benzamides and analogues as insecticides ACHE, CHRM1, NIT2 GPR52 1660/4885MKNK1 2653/4885MKNK2 2026/4885
US-20140350261-A1 METHOD FOR CATALYTIC ASYMMETRIC SYNTHESIS OF OPTICALLY ACTIVE ISOXAZOLINE COMPOUND, AND OPTICALLY ACTIVE ISOXAZOLINE COMPOUND CYP3A7, CYP2A7, CYP8B1 GPR52 1945/4885MKNK1 3016/4885MKNK2 2840/4885

“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.