SCHEMBL6058573

SCHEMBL6058573

CSc1cc(C(=O)O)cc(Br)c1-c1ccc(O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.36
ABL1 P00519 1/20 0.33
AR P10275 1/20 0.33
PREP P48147 2/20 0.31
PTGFR P43088 1/20 0.31
LIPE Q05469 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
CTRC Q99895 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
SCHEMBL6698482 0.91 ABL1 (0.43) ABL1LIPE
SCHEMBL6059070 0.82 MCL1 (0.35) MCL1ABL1PREP
SCHEMBL12919164 0.75 CA1 (0.46)
SCHEMBL6860354 0.73 ABL1 (0.42) ABL1PREP
Ammonia Solution, Strong SCHEMBL6697477 0.73 ABL1 (0.41) ABL1PREP
SCHEMBL7259643 0.71 KDM4E (0.37) MCL1ABL1
SCHEMBL6058804 0.71 PREP (0.46) MCL1PREPTHRATHRB
SCHEMBL4514274 0.70 IDO1 (0.39) ABL1
SCHEMBL13586884 0.70 ELANE (0.39)
SCHEMBL27358205 0.69 AKR1C3 (0.53)

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-0877607-B1 BIPHENYL COMPOUNDS AND USE THEREOF AS OESTROGENIC AGENTS AVENTIS PHARMA SA (FR) 2006-11-15 EP disclosed