SCHEMBL4644070

SCHEMBL4644070

O=C(CCl)C(=O)C(Cl)(Cl)Cl

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 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
SCHEMBL4644088 0.77 ALDH1A1 (0.33) TSHRALDH1A1TP53
SCHEMBL4645694 0.75 OR51E2 (0.40) TSHRALDH1A1TP53
SCHEMBL7947984 0.73 FFAR3 (0.35) TSHRALDH1A1TP53
SCHEMBL4642492 0.73 TSHR (0.35) TSHRALDH1A1
SCHEMBL4644453 0.73 TSHR (0.35) TSHR
SCHEMBL4643485 0.73 TSHR (0.35) TSHR
SCHEMBL4641946 0.73 CES2 (0.31) TSHRALDH1A1TP53
SCHEMBL6282434 0.71 ALDH1A1 (0.54) TSHRALDH1A1TP53
SCHEMBL298779 0.71
SCHEMBL4644264 0.71 CES2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4988685-A Cephalosporins derivatives BAYER AKTIENGESELLSCHAFT (DE) 1991-01-29 US claimed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed