SCHEMBL124475

SCHEMBL124475

O=C(O)c1cc2cc(F)c(N3CCOCC3)nc2nc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.40
PKM P14618 1/20 0.39
KDM4E B2RXH2 4/20 0.39
SLC16A3 O15427 1/20 0.37
PIK3R1 P27986 2/20 0.37
PIK3CA P42336 1/20 0.37
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
ATP6V1B2 P21281 1/20 0.36
TBXA2R P21731 1/20 0.36
EDNRA P25101 1/20 0.36
TARBP2 Q15633 1/20 0.36
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PIK3C2B O00750 3/20 0.36
GAA P10253 3/20 0.35
AKT1 P31749 1/20 0.35
PIK3CD O00329 2/20 0.35
PIK3CB P42338 2/20 0.35
PDE4A P27815 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
SCHEMBL125193 0.84 ALDH1A1 (0.50) KDM4EALDH1A1
SCHEMBL124692 0.82 CNR2 (0.32) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL124680 0.80 PKM (0.47) GLAPKMKDM4ESLC16A3PIK3CA
SCHEMBL123588 0.79 ACACB (0.36) KDM4ELMNAALDH1A1
SCHEMBL126379 0.73 GFER (0.38) KDM4E
SCHEMBL126280 0.73 GFER (0.43) KDM4EALDH1A1
SCHEMBL125619 0.72 MAPT (0.34) ALDH1A1
SCHEMBL15923640 0.71 PKM (0.50) GLAPKMKDM4EPIK3CACNR2
SCHEMBL122742 0.71 GFER (0.34) KDM4E
SCHEMBL3433966 0.71 GFER (0.34) KDM4E

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 GLA 2988/4885PKM 2313/4885KDM4E 1231/4885

“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.