SCHEMBL13041420

SCHEMBL13041420

Cc1sc(-c2ccc(Cl)cc2F)nc1C1C(=O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 5/20 0.36
▸ BCHE P06276 2/20 0.36
▸ APEX1 P27695 1/20 0.34
▸ MAP3K14 Q99558 1/20 0.34
▸ BACE1 P56817 2/20 0.33
▸ BACE2 Q9Y5Z0 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CTSD P07339 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ ADORA2B P29275 1/20 0.32
▸ SHMT1 P34896 1/20 0.32
▸ SHMT2 P34897 1/20 0.32
▸ HSD11B1 P28845 2/20 0.32
▸ S1PR1 P21453 1/20 0.32

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
SCHEMBL13041383 0.88 APEX1 (0.35) GRM2BCHEAPEX1MAP3K14BACE1
SCHEMBL13041489 0.87 POLB (0.34) MAP3K14BACE1BACE2
SCHEMBL13041476 0.86 GRM2 (0.35) GRM2BCHEBACE1BACE2CTSD
SCHEMBL13041400 0.81 RAB9A (0.40) APEX1LMNA
SCHEMBL13041415 0.80 PTPN11 (0.34) GRM2APEX1
SCHEMBL10237926 0.78 GRM2 (0.39) GRM2BCHEAPEX1MAP3K14SHMT1
SCHEMBL13041501 0.77 POLB (0.35) —
SCHEMBL13041534 0.77 CRHR1 (0.35) BACE1BACE2SHMT1SHMT2
SCHEMBL13041511 0.76 GLA (0.36) GRM2SHMT1SHMT2
SCHEMBL13041468 0.76 NOTUM (0.34) GRM2LMNASHMT1SHMT2

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-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
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
WO-2009000533-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2008-12-31 — — 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-20100279868-A1 NOVEL HERBICIDES DDT, HPD, HSD17B1 GRM2 156/4885BCHE 425/4885APEX1 3523/4885

“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