SCHEMBL123502

SCHEMBL123502

Cc1ccc2cc(C(=O)O)c(C(F)(F)Cl)nc2n1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 8/20 0.37
ALDH1A1 P00352 1/20 0.37
ACLY P53396 1/20 0.35
GFER P55789 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ABCC4 O15439 1/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
PTGS1 P23219 1/20 0.34
DHODH Q02127 1/20 0.33
NOTUM Q6P988 1/20 0.33

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
SCHEMBL125802 0.88 GFER (0.43) SORT1ALDH1A1GFERMEN1KMT2A
SCHEMBL126121 0.85 RXFP1 (0.37) ALDH1A1
SCHEMBL125592 0.74 ALDH1A1 (0.39) SORT1ALDH1A1ACLYMEN1KMT2A
SCHEMBL124762 0.74 XPO1 (0.46) ALDH1A1GFERDHODH
SCHEMBL126118 0.73 GFER (0.39) SORT1ALDH1A1GFERLMNANOTUM
SCHEMBL3431847 0.73 KDM4E (0.39) SORT1ALDH1A1GFER
SCHEMBL122983 0.72 TAS2R14 (0.40) ALDH1A1ACLYGFERLMNADHODH
SCHEMBL125060 0.71 GFER (0.39) SORT1ALDH1A1GFERLMNADHODH
SCHEMBL125428 0.71 GFER (0.39) SORT1ALDH1A1GFERNOTUM
SCHEMBL28008297 0.71 GFER (0.39) SORT1ALDH1A1GFERMEN1KMT2A

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-8461083-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2013-06-11 US disclosed
EP-2265120-B1 HERBICIDAL COUMPOUNDS SYNGENTA LTD (GB) 2012-03-07 EP disclosed
US-20110021352-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-27 US disclosed
EP-2265120-A1 HERBICIDAL COUMPOUNDS Syngenta Limited (GB) 2010-12-29 EP disclosed
WO-2009115788-A1 HERBICIDAL COUMPOUNDS SYNGENTA LIMITED (GB) 2009-09-24 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-20110021352-A1 HERBICIDAL COMPOUNDS RDX, NQO2, DDT SORT1 3099/4885ALDH1A1 677/4885ACLY 197/4885

“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.