SCHEMBL27587735

SCHEMBL27587735

O=C(Cl)C(F)F.c1cc2ccc1o2

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL5848574 0.78 ALDH1A1 (0.31) ALDH1A1
SCHEMBL22044 0.76
SCHEMBL9834881 0.76
Dichloroacetic Acid SCHEMBL4424191 0.74 LMNA (0.53) ALDH1A1
SCHEMBL5273126 0.72 LMNA (0.35) ALDH1A1
Acetic Acid SCHEMBL11212519 0.69 FFAR3 (0.44) ALDH1A1
Toluene SCHEMBL29078529 0.69 LMNA (0.50) ALDH1A1
SCHEMBL442721 0.68 GSK3B (0.36) ALDH1A1
Chloroacetic Acid SCHEMBL11683671 0.68 TSHR (0.53) ALDH1A1
SCHEMBL5334623 0.68 ALDH1A1 (0.36) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103588814-A Optically active isomer of substituted phenoxyl acetyloxy (amino) hydrocarbyl phosphonate with herbicidal activity and preparation thereof UNIV HUAZHONG NORMAL 2014-02-19 CN disclosed
CN-100412078-C Fluorine substituted phenoxy acetyl oxide alkyl phosphonate ester and salt with weeding active and preparation process thereof UNIV HUAZHONG (CN) 2008-08-20 CN disclosed
CN-1560058-A Fluorine substituted phenoxy acetyl oxide alkyl phosphonate ester and salt with weeding active and preparation process thereof 华中师范大学 2005-01-05 CN disclosed