SCHEMBL127223

SCHEMBL127223

CCOC(=O)c1cc2cc(F)c(C)nc2nc1C(F)F

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
KDM4E B2RXH2 5/20 0.40
HSD17B10 Q99714 2/20 0.39
ACHE P22303 4/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
ALOX15 P16050 1/20 0.38
JMJD6 Q6NYC1 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
ATM Q13315 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL124786 0.82 KEAP1 (0.35) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL124872 0.81 TSHR (0.43) TSHRKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL125222 0.80 KDM4E (0.51) TSHRKDM4EACHEALDH1A1HPGD
SCHEMBL123349 0.78 TSHR (0.43) TSHRKDM4EHSD17B10ACHEALDH1A1
SCHEMBL125211 0.77 TSHR (0.43) TSHRKDM4EHSD17B10ACHEALDH1A1
SCHEMBL125322 0.76 TSHR (0.40) TSHRKDM4EHSD17B10ACHEALDH1A1
SCHEMBL27838090 0.76 TSHR (0.42) TSHRKDM4EHSD17B10ALDH1A1GAA
SCHEMBL129012 0.75 TSHR (0.41) TSHRKDM4EHSD17B10ACHEALDH1A1
SCHEMBL125281 0.74 HPD (0.33)
SCHEMBL122914 0.74 KDM4E (0.40) TSHRKDM4EHSD17B10ACHEALDH1A1

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 6 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
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 TSHR 1704/4885KDM4E 1231/4885HSD17B10 2099/4885

“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.