SCHEMBL14536663

SCHEMBL14536663

CC(=O)c1cc(OCCN)cc(OCCN)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ GAA P10253 1/20 0.47
▸ PLA2G2A P14555 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ PLAU P00749 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TAAR1 Q96RJ0 1/20 0.41
▸ MAOB P27338 2/20 0.39
▸ CA5A P35218 1/20 0.39
▸ ESR1 P03372 2/20 0.39
▸ CYP19A1 P11511 2/20 0.39
▸ ESR2 Q92731 2/20 0.39
▸ BRD4 O60885 1/20 0.38
▸ BRD2 P25440 1/20 0.38
▸ CREBBP Q92793 1/20 0.38

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
SCHEMBL4368371 0.82 PARP10 (0.46) PLA2G2AALDH1A1PLAUMEN1KMT2A
SCHEMBL9702910 0.82 PLA2G2A (0.56) L3MBTL1GAAPLA2G2AALDH1A1MAPT
SCHEMBL2188463 0.82 PLA2G2A (0.61) PLA2G2AALDH1A1MAPTPLAUMEN1
SCHEMBL755574 0.82 MAOB (0.60) ALDH1A1MEN1KMT2AMAOB
SCHEMBL757971 0.81 L3MBTL1 (0.75) L3MBTL1GAAALDH1A1MAPTMAOB
SCHEMBL9970987 0.81 PLA2G2A (0.64) L3MBTL1GAAPLA2G2AALDH1A1MAPT
SCHEMBL14227712 0.81 MAPT (0.49) L3MBTL1GAAPLA2G2AALDH1A1MAPT
SCHEMBL17531343 0.81 L3MBTL1 (0.53) L3MBTL1GAAPLA2G2AALDH1A1MAPT
SCHEMBL16471652 0.79 L3MBTL1 (0.56) L3MBTL1GAAPLA2G2AALDH1A1MAPT
SCHEMBL11387851 0.79 PLA2G2A (0.72) L3MBTL1GAAPLA2G2AKMT2A

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
US-7211241-B2 Cascade polymer complexes, process for their production and pharmaceutical agents containing said complexes SCHERING AKTIENGESELLSCHAFT (DE) 2007-05-01 — — US disclosed
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