SCHEMBL27685440

SCHEMBL27685440

Cc1ccc(C)c(-c2cc(C)c(O)c(Cl)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C2 P52895 2/20 0.41
▸ AKR1C1 Q04828 2/20 0.41
▸ TTR P02766 1/20 0.40
▸ ESRRA P11474 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ PTGS1 P23219 3/20 0.38
▸ PTGS2 P35354 3/20 0.38
▸ ALOX5 P09917 2/20 0.38
▸ ALKBH3 Q96Q83 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ S1PR4 O95977 2/20 0.36
▸ HSD17B1 P14061 1/20 0.35
▸ HSD17B2 P37059 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ GAA P10253 2/20 0.35

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
SCHEMBL22500364 0.87 CA1 (0.54) ESRRACA1CA2PTGS1PTGS2
SCHEMBL27704405 0.85 AKR1C2 (0.39) AKR1C2AKR1C1TTRESRRAPTGS1
SCHEMBL6333547 0.80 AKR1C2 (0.38) AKR1C2AKR1C1TTRCA1CA2
SCHEMBL27704422 0.79 RPS6KA3 (0.45) ESRRACA1CA2PTGS1PTGS2
SCHEMBL27704409 0.79 ESR2 (0.47) AKR1C2AKR1C1ESRRACA1CA2
SCHEMBL27704412 0.79 ESRRA (0.40) ESRRACA1CA2PTGS1PTGS2
SCHEMBL11788820 0.72 TTR (0.70) AKR1C2AKR1C1TTRCA1CA2
SCHEMBL714974 0.72 ALDH1A1 (0.42) ESRRATP53TDP1S1PR4ALDH1A1
SCHEMBL21021412 0.72 ADORA1 (0.36) ESRRAALKBH3TDP1S1PR4ALDH1A1
SCHEMBL20136961 0.72 TP53 (0.61) ESRRATP53TDP1S1PR4HSD17B1

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
CN-101001887-B Multi-branched polymer and method for producing same NIPPON SODA CO.,LTD. (JP) 2012-02-08 — — CN disclosed
CN-101593852-B Multibranched polymers and process for production thereof NIPPON SODA CO 2011-03-02 — — CN disclosed
CN-101593852-A Multibranched polymers and manufacture method thereof NIPPON SODA CO (JP) 2009-12-02 — — CN disclosed
CN-101001887-A Multi-branched polymer and method for producing same NIPPON SODA CO (JP) 2007-07-18 — — CN disclosed
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