SCHEMBL2467572

SCHEMBL2467572

CSc1cc(C)c(C(Br)C=O)c(C)c1

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
SCHEMBL3410995 0.79 ERN1 (0.32) ALDH1A1
SCHEMBL22833975 0.79 ERN1 (0.32) ALDH1A1
SCHEMBL2464216 0.78 HPGD (0.35) ALDH1A1
SCHEMBL2466146 0.78 MCL1 (0.39) ALDH1A1
SCHEMBL14992136 0.76 ALDH1A1 (0.33) ALDH1A1
SCHEMBL14992458 0.76 CYP3A4 (0.38) ALDH1A1
SCHEMBL2463070 0.76 CES1 (0.32)
SCHEMBL21495062 0.74 POLB (0.39) ALDH1A1
SCHEMBL2461408 0.73 ALDH1A1 (0.37) ALDH1A1
SCHEMBL14993162 0.73 MAPT (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
EP-2785714-A1 IMPROVED MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR Taivex Therapeutics Corporation (TW) 2014-10-08 EP disclosed
WO-2013082324-A1 IMPROVED MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR TAIVEX THERAPEUTICS CORPORATION (TW) 2013-06-06 WO disclosed
EP-2547676-A2 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR Taivex Therapeutics Inc. (TW) 2013-01-23 EP disclosed
WO-2011115998-A2 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR TAIVEX THERAPEUTICS INC. (CN) 2011-09-22 WO disclosed