SCHEMBL4214812

SCHEMBL4214812

CC=Cc1cccc(Br)c1C

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.37
▸ HSD11B1 P28845 2/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ LY96 Q9Y6Y9 1/20 0.32
▸ APLNR P35414 1/20 0.30
▸ HMGCR P04035 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ HSP90AA1 P07900 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ MAPK1 P28482 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
SCHEMBL12913343 1.00 ALDH1A1 (0.37) ALDH1A1HSD11B1ESR1ESR2LY96
SCHEMBL21786281 1.00 ALDH1A1 (0.37) ALDH1A1HSD11B1ESR1ESR2LY96
SCHEMBL31028928 0.91 ESR1 (0.39) ALDH1A1ESR1ESR2APLNRHMGCR
SCHEMBL9812208 0.81 HSD11B1 (0.54) ALDH1A1HSD11B1LY96MEN1NPC1
SCHEMBL265503 0.81 HSD11B1 (0.54) ALDH1A1HSD11B1LY96MEN1NPC1
SCHEMBL2582420 0.81 HSD11B1 (0.54) ALDH1A1HSD11B1LY96MEN1NPC1
SCHEMBL13747892 0.80 ALDH1A1 (0.46) ALDH1A1ESR1ESR2MEN1KMT2A
SCHEMBL9468753 0.79 TRPA1 (0.41) ALDH1A1ESR1ESR2APLNRHMGCR
SCHEMBL20258533 0.79 TRPA1 (0.41) ALDH1A1ESR1ESR2APLNRHMGCR
SCHEMBL10394775 0.79 TRPA1 (0.41) ALDH1A1ESR1ESR2APLNRHMGCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822592-B2 Aqueous emulsion polymer as dispersant BASF SE (DE) 2014-09-02 — — US disclosed
US-20090234062-A1 Aqueous emulsion polymer as dispersant CIBA SPECIALTY CHEMICALS CORP. 2009-09-17 — — US disclosed
CN-100364649-C Aqueous emulsion polymer as dispersant EFKA ADDITIVES B V (NL) 2008-01-30 — — CN disclosed
EP-1562696-B1 AQUEOUS EMULSION POLYMER AS DISPERSANT CIBA SC HOLDING AG (CH) 2006-03-29 — — EP disclosed
CN-1713955-A Aqueous emulsion polymers as dispersants EFKA ADDITIVES B V (NL) 2005-12-28 — — CN disclosed
EP-1562696-A2 AQUEOUS EMULSION POLYMER AS DISPERSANT Efka Additives B.V. (NL) 2005-08-17 — — EP disclosed
WO-2004045755-A2 AQUEOUS EMULSION POLYMER AS DISPERSANT EFKA ADDITIVES B.V. (NL) 2004-06-03 — — WO disclosed
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