SCHEMBL28827041

SCHEMBL28827041

Cc1cc(C)cc(N=Nc2c(S)ccc3ccccc23)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 4/20 0.45
▸ MAPT P10636 7/20 0.43
▸ KMT2A Q03164 5/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ PKM P14618 1/20 0.43
▸ L3MBTL1 Q9Y468 5/20 0.43
▸ TDP1 Q9NUW8 5/20 0.43
▸ GAA P10253 2/20 0.43
▸ SENP7 Q9BQF6 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ HSP90AA1 P07900 2/20 0.43
▸ ALPL P05186 1/20 0.43
▸ ALPI P09923 1/20 0.43
▸ ALPG P10696 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ MMP14 P50281 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43

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
SCHEMBL28060056 0.83 SENP2 (0.53) THRBMAPTKMT2AMEN1ALDH1A1
SCHEMBL27977465 0.83 THRB (0.69) THRBMAPTKMT2AMEN1ALDH1A1
SCHEMBL17923173 0.77 THRB (0.72) THRBMAPTKMT2AMEN1ALDH1A1
SCHEMBL17923172 0.77 THRB (0.72) THRBMAPTKMT2AMEN1ALDH1A1
SCHEMBL28219746 0.75 MEN1 (0.49) THRBMAPTKMT2AMEN1ALDH1A1
SCHEMBL29208590 0.71 THRB (0.69) THRBMAPTKMT2AMEN1ALDH1A1
SCHEMBL29208591 0.71 THRB (0.69) THRBMAPTKMT2AMEN1ALDH1A1
SCHEMBL30776092 0.71 THRB (0.69) THRBMAPTKMT2AMEN1ALDH1A1
SCHEMBL10813112 0.68 ALDH1A1 (0.60) MAPTKMT2AMEN1ALDH1A1PKM
SCHEMBL12133347 0.68 THRB (0.62) THRBMAPTKMT2AMEN1ALDH1A1

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
CN-105473629-A Star-shaped vinyl ether polymer MARUZEN PETROCHEM CO LTD 2016-04-06 — — CN disclosed
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