SCHEMBL7530202

SCHEMBL7530202

Nc1c(Br)c(C(=O)Cl)c(Br)c(C(=O)Cl)c1Br

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL7526071 0.91
SCHEMBL11052757 0.86 ALDH1A1 (0.39) ALDH1A1
SCHEMBL11786595 0.80 ALDH1A1 (0.36) ALDH1A1
SCHEMBL4658253 0.80 ALDH1A1 (0.39) ALDH1A1
SCHEMBL10332292 0.77 ALDH1A1 (0.38) ALDH1A1
SCHEMBL10615599 0.76 ALDH1A1 (0.40) ALDH1A1
SCHEMBL7525587 0.76 F2 (0.35)
Hydrochloric Acid SCHEMBL11061038 0.74 F2 (0.34)
SCHEMBL9535859 0.71 ALDH1A1 (0.38) ALDH1A1
SCHEMBL7523328 0.70 F2 (0.35)

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
EP-1186305-A1 New brominated compounds as contrast media for X-ray mammography Schering Aktiengesellschaft (DE) 2002-03-13 EP disclosed
US-4474747-A BROMO-AND I/DO-BENZENE COMPOUNDS GUERBET S.A. (FR) 1984-10-02 US disclosed