SCHEMBL597200

SCHEMBL597200

COC=C(C(=O)OC)C(=O)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MAPT P10636 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
SCHEMBL597199 1.00 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL18936296 0.84
SCHEMBL18936294 0.84
SCHEMBL26005755 0.81 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL3923030 0.81 NPSR1 (0.44) ALDH1A1MAPT
SCHEMBL8932240 0.81 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL18936274 0.81 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL3923025 0.81 NPSR1 (0.44) ALDH1A1MAPT
SCHEMBL166090 0.79 ALDH1A1 (0.39) ALDH1A1MAPT
SCHEMBL28347468 0.79 L3MBTL1 (0.31) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3178813-A1 METHOD FOR PREPARING HALOGENATED 3-OXOCARBOXYLATES CARRYING A 2-ALKOXYMETHYLIDENE OR A 2-DIALKYLAMINOMETHYLIDENE GROUP BASF SE (DE) 2017-06-14 EP disclosed
US-8115012-B2 Process for preparing difluoromethylpyrazolyl carboxylates BASF SE (DE) 2012-02-14 US disclosed
US-20100069646-A1 Process for preparing difluoromethylpyrazolyl carboxylates BASF SE (DE) 2010-03-18 US 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-20100069646-A1 Process for preparing difluoromethylpyrazolyl carboxylates HCN2, HCN3, C9 ALDH1A1 3542/4885MAPT 4855/4885

“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.