SCHEMBL9848307

SCHEMBL9848307

O=C(Cl)c1ccc(C2(c3ccc(C(=O)Cl)cc3)C(F)(F)C(F)(F)C(F)(F)C2(F)F)cc1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL106104 0.75 ALDH1A1 (0.39) ALDH1A1
SCHEMBL20587670 0.74 ALDH1A1 (0.59) ALDH1A1
SCHEMBL68148 0.74 ALDH1A1 (0.59) ALDH1A1
Hydrogen Sulfide SCHEMBL10896015 0.71 ALDH1A1 (0.56) ALDH1A1
SCHEMBL6758498 0.71 ALDH1A1 (0.64) ALDH1A1
SCHEMBL28787222 0.71 ALDH1A1 (0.56) ALDH1A1
Hydrochloric Acid SCHEMBL2362644 0.71 ALDH1A1 (0.56) ALDH1A1
Ammonia Solution, Strong SCHEMBL2023211 0.71 ALDH1A1 (0.56) ALDH1A1
SCHEMBL9764749 0.71 ALDH1A1 (0.36) ALDH1A1
SCHEMBL10554150 0.70 ALOX15 (0.42) 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-0438715-A2 1,1-Bicyclo-substituted fluorinated cyclopentanes and method for their production BAYER AG (DE) 1991-07-31 EP disclosed