SCHEMBL125592

SCHEMBL125592

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
SORT1 Q99523 7/20 0.34
ACLY P53396 1/20 0.34
PPARA Q07869 1/20 0.33
ABCC4 O15439 1/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
PTGS1 P23219 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PARP1 P09874 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 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
SCHEMBL124872 0.82 TSHR (0.43) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL127232 0.79 HPD (0.36)
SCHEMBL123997 0.76 KDM4E (0.47) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL125802 0.76 GFER (0.43) ALDH1A1MEN1KMT2ASORT1ABCC4
SCHEMBL123502 0.74 SORT1 (0.37) ALDH1A1MEN1KMT2ASORT1ACLY
SCHEMBL129108 0.70 ALDH1A1 (0.36) ALDH1A1MEN1KMT2APPARAKDM4E
SCHEMBL126097 0.69 ALDH1A1 (0.41) ALDH1A1MEN1KMT2APKMKDM4E
SCHEMBL23858444 0.67 ALDH1A1 (0.53) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL10511130 0.67 PARP1 (0.49) ALDH1A1MEN1KMT2ALMNAPKM
SCHEMBL30251776 0.67 ALDH1A1 (0.53) ALDH1A1MEN1KMT2ALMNAKDM4E

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 ALDH1A1 677/4885MEN1 1810/4885KMT2A 1162/4885

“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.