SCHEMBL13041498

SCHEMBL13041498

Cc1sc(-c2ccc(Br)cn2)nc1C1C(=O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 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
SCHEMBL13078088 0.87 — —
SCHEMBL13986204 0.86 — —
SCHEMBL13041515 0.85 ADAMTS5 (0.31) —
SCHEMBL13041406 0.83 NPC1 (0.36) NPC1
SCHEMBL13041501 0.79 POLB (0.35) RAB9A
SCHEMBL13041489 0.77 POLB (0.34) —
SCHEMBL10237976 0.77 SPR (0.32) —
SCHEMBL13041408 0.74 MEN1 (0.33) —
SCHEMBL13041410 0.74 PIK3CD (0.40) —
SCHEMBL13041400 0.73 RAB9A (0.40) NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — 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 (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-20100279868-A1 NOVEL HERBICIDES DDT, HPD, HSD17B1 GSK3A 3983/4885GSK3B 3817/4885NPC1 4588/4885

“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.

Send feedback