SCHEMBL9728286

SCHEMBL9728286

C=C(C)C(=O)OC(F)(F)C1(F)OC1(F)F

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 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
SCHEMBL340930 0.76 ALDH1A1 (0.37) ALDH1A1
SCHEMBL26363014 0.71 ALDH1A1 (0.33) ALDH1A1
Methacrylic Acid SCHEMBL1617292 0.71
Methacrylic Acid SCHEMBL7655599 0.71
SCHEMBL10899304 0.71 ALDH1A1 (0.48) ALDH1A1
SCHEMBL31364542 0.71 ALDH1A1 (0.48) ALDH1A1
SCHEMBL268102 0.71 ALDH1A1 (0.48) ALDH1A1
SCHEMBL372455 0.70 TDP1 (0.40) ALDH1A1
SCHEMBL4936229 0.69 TSHR (0.41) ALDH1A1
SCHEMBL3134330 0.69 ALDH1A1 (0.46) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5141661-A Wear resistant oil additive TEXACO INC. (US) 1992-08-25 US claimed
US-5141661-A Wear resistant oil additive TEXACO INC. (US) 1992-08-25 US disclosed