SCHEMBL125802

SCHEMBL125802

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

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.43
SORT1 Q99523 8/20 0.41
ALDH1A1 P00352 1/20 0.39
NOTUM Q6P988 2/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ABCC4 O15439 1/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
PTGS1 P23219 1/20 0.35
RBP4 P02753 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
SCHEMBL123502 0.88 SORT1 (0.37) GFERSORT1ALDH1A1NOTUMMEN1
SCHEMBL3431847 0.84 KDM4E (0.39) GFERSORT1ALDH1A1KDM4ENPSR1
SCHEMBL126118 0.84 GFER (0.39) GFERSORT1ALDH1A1NOTUMKDM4E
SCHEMBL122983 0.83 TAS2R14 (0.40) GFERALDH1A1KDM4ELMNA
SCHEMBL125060 0.82 GFER (0.39) GFERSORT1ALDH1A1NOTUMRXRA
SCHEMBL125428 0.82 GFER (0.39) GFERSORT1ALDH1A1NOTUMKDM4E
SCHEMBL28008297 0.82 GFER (0.39) GFERSORT1ALDH1A1NOTUMRXRA
SCHEMBL125663 0.82 KDM4E (0.53) ALDH1A1KDM4ENPSR1MEN1KMT2A
SCHEMBL124762 0.82 XPO1 (0.46) GFERALDH1A1KDM4E
SCHEMBL27838153 0.81 TDP1 (0.48) GFERSORT1ALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102006777-B Herbicidal compounds SYNGENTA LTD 2015-04-01 CN disclosed
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
CN-102006777-A Herbicidal coumpounds SYNGENTA LTD 2011-04-06 CN 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 GFER 986/4885SORT1 3099/4885ALDH1A1 677/4885

“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.