SCHEMBL900752

SCHEMBL900752

C#CCN1C(=O)C(F)(F)Oc2cc(F)c(NN)cc21

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL10233688 0.88 VRK1 (0.30) ALDH1A1GAA
SCHEMBL20680535 0.87 NR3C2 (0.37) ALDH1A1GAA
SCHEMBL12098094 0.85 ALDH1A1 (0.32) ALDH1A1GAA
SCHEMBL900540 0.84
SCHEMBL30704859 0.84 PGR (0.32) ALDH1A1GAA
SCHEMBL900663 0.84 PGR (0.32) ALDH1A1GAA
SCHEMBL12168471 0.81 ALDH1A1 (0.32) ALDH1A1GAA
SCHEMBL1802016 0.80 ALDH1A1 (0.37) ALDH1A1
SCHEMBL900315 0.80
SCHEMBL2606236 0.79 PGR (0.35) ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2621924-B1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2015-03-04 EP disclosed
EP-2621924-B1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2015-03-04 EP disclosed
US-8669208-B2 Herbicidal benzoxazinones BASF SE (DE) 2014-03-11 US disclosed
US-8669208-B2 Herbicidal benzoxazinones BASF SE (DE) 2014-03-11 US disclosed
US-8669208-B2 Herbicidal benzoxazinones BASF SE (DE) 2014-03-11 US disclosed
EP-2621924-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2013-08-07 EP disclosed
US-20130184155-A1 Herbicidal Benzoxazinones BASF SE (DE) 2013-07-18 US disclosed
US-20130184155-A1 Herbicidal Benzoxazinones BASF SE (DE) 2013-07-18 US disclosed
US-20130184155-A1 Herbicidal Benzoxazinones BASF SE (DE) 2013-07-18 US disclosed
WO-2012041789-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2012-04-05 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-20130184155-A1 Herbicidal Benzoxazinones CBR3, HAX1, CBR1 ALDH1A1 320/4885GAA 2602/4885

“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.