SCHEMBL30426570

SCHEMBL30426570

CN(C)C(=O)/C(C#N)=C/c1cn(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ncccc12

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.51
▸ SNCA P37840 4/20 0.51
▸ ENPP2 Q13822 1/20 0.45
▸ PTGDR2 Q9Y5Y4 10/20 0.41
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ SLC16A1 P53985 1/20 0.38
▸ ELANE P08246 1/20 0.37

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
SCHEMBL20603144 0.89 APP (0.57) APPSNCAENPP2PTGDR2ALDH1A1
SCHEMBL28377102 0.89 APP (0.57) APPSNCAENPP2PTGDR2ALDH1A1
SCHEMBL30426945 0.88 APP (0.53) APPSNCAENPP2ALDH1A1LMNA
SCHEMBL30426119 0.88 APP (0.55) APPSNCAENPP2ALDH1A1LMNA
SCHEMBL30426699 0.88 APP (0.51) APPSNCAENPP2ALDH1A1SLC16A1
SCHEMBL25773497 0.86 SNCA (0.53) APPSNCAENPP2ALDH1A1LMNA
SCHEMBL29395523 0.86 APP (0.49) APPSNCAENPP2ALDH1A1LMNA
SCHEMBL20615236 0.86 APP (0.49) APPSNCAENPP2ALDH1A1LMNA
SCHEMBL29919467 0.86 APP (0.49) APPSNCAENPP2ALDH1A1LMNA
SCHEMBL30340916 0.86 APP (0.49) APPSNCAENPP2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4172158-A1 COMPOSITIONS AND METHODS FOR MODULATING HAIR GROWTH The Regents of the University of California (US) 2023-05-03 — — EP disclosed
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