SCHEMBL19361069

SCHEMBL19361069

COC(C)(C(C)(F)F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL8445908 0.86 ALDH1A1 (0.40) ALDH1A1
SCHEMBL22624054 0.80 ALDH1A1 (0.35) ALDH1A1
SCHEMBL20274346 0.76
SCHEMBL11911322 0.73 ALDH1A1 (0.35) ALDH1A1
SCHEMBL11032985 0.73 LMNA (0.35) ALDH1A1
SCHEMBL14561703 0.67
SCHEMBL15274248 0.67
SCHEMBL2297967 0.67
SCHEMBL23667242 0.67 ALDH1A1 (0.30) ALDH1A1
SCHEMBL12013955 0.67 ALDH1A1 (0.35) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2884982-B1 SUBSTITUTED PHENYL SPLEEN TYROSINE KINASE (Syk) INHIBITORS MERCK SHARP & DOHME (US) 2017-09-20 EP disclosed