SCHEMBL3704273

SCHEMBL3704273

CC1(C)[C@H](/C=C2\CCSC2=O)[C@@]1(Cc1coc(Cc2ccccc2)c1)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.35

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
SCHEMBL6131404 1.00 IDH1 (0.35) IDH1
SCHEMBL10585803 0.79 IDH1 (0.35) IDH1
SCHEMBL10585806 0.79 IDH1 (0.35) IDH1
SCHEMBL3513116 0.78 IDH1 (0.40) IDH1
SCHEMBL7536857 0.78 IDH1 (0.40) IDH1
SCHEMBL7916536 0.78 IDH1 (0.40) IDH1
SCHEMBL8321135 0.78 IDH1 (0.40) IDH1
SCHEMBL11436250 0.78 IDH1 (0.40) IDH1
SCHEMBL739613 0.78 IDH1 (0.39) IDH1
SCHEMBL5082139 0.77 IDH1 (0.36) IDH1

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
US-8431514-B2 4-cyano-3-benzoylamino-N-phenyl-benzamides for use in pest control SYNGENTA CROP PROTECTION LLC (US) 2013-04-30 US disclosed
US-20120122975-A1 4-CYANO-3-BENZOYLAMINO-N-PHENYL-BENZAMIDES FOR USE IN PEST CONTROL SYNGENTA CROP PROTECTION LLC (US) 2012-05-17 US disclosed
US-20030199709-A1 Process for the preparation of enantiomerically pure pyrethroid insecticides SYNGENTA LIMITED (GB) 2003-10-23 US disclosed
US-6093726-A AN INSECTICIDES, ACARICIDES OR NEMATICIDES ZENECA LIMITED (GB) 2000-07-25 US disclosed
US-5849754-A Bicyclic amine derivatives ZENECA LIMITED (GB) 1998-12-15 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 (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-20030199709-A1 Process for the preparation of enantiomerically pure pyrethroid insecticides CYP4B1, CYP4A11, DDT IDH1 318/4885
US-20120122975-A1 4-CYANO-3-BENZOYLAMINO-N-PHENYL-BENZAMIDES FOR USE IN PEST CONTROL NISCH, AADAC, ACHE IDH1 1528/4885

“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.