SCHEMBL19088670

SCHEMBL19088670

C=C(C)/C=C\C(=C)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 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
SCHEMBL12449872 0.80
SCHEMBL12594150 0.79
SCHEMBL21377347 0.79
SCHEMBL20628127 0.79
SCHEMBL18687188 0.77 ALDH1A1 (0.37) ALDH1A1TP53TSHR
SCHEMBL13862840 0.75
SCHEMBL26003193 0.75
SCHEMBL20220120 0.75
SCHEMBL20083695 0.75
SCHEMBL852156 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3101015-B1 HETEROCYCLIC SULFONAMIDE DERIVATIVE AND MEDICINE COMPRISING SAME EA PHARMA CO LTD (JP) 2019-09-18 EP disclosed
EP-2635274-B1 ANTI-STAPHYLOCOCCAL CELECOXIB DERIVATIVES UNIV OHIO STATE RES FOUND (US) 2017-12-06 EP disclosed
WO-2017167631-A1 POLYMERIC ORGANIC NANOPARTICLES WITH ENHANCED EMISSION SONY CORPORATION (JP) 2017-10-05 WO disclosed
WO-2017116702-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS MERIAL, INC. (US) 2017-07-06 WO disclosed