SCHEMBL29052060

SCHEMBL29052060

O=C(O)COc1ccc(C=CC(C=Cc2ccc(OCC(=O)O)cc2)=C(C=Cc2ccc(OCC(=O)O)cc2)C=Cc2ccc(OCC(=O)O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.59
▸ MEN1 O00255 3/20 0.59
▸ NPC1 O15118 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ KDM4E B2RXH2 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ ALOX15 P16050 1/20 0.55
▸ BLM P54132 2/20 0.54
▸ GPR35 Q9HC97 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ MAPT P10636 2/20 0.53
▸ NR1I2 O75469 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ PGR P06401 1/20 0.51
▸ ADRB2 P07550 1/20 0.51
▸ ADRB1 P08588 1/20 0.51
▸ ADORA3 P0DMS8 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ CNR1 P21554 1/20 0.51

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
SCHEMBL19900738 0.89 THRB (0.61) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL11693509 0.89 THRB (0.61) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL20024689 0.89 ALOX15 (0.63) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL11459734 0.85 KMT2A (0.75) KMT2AMEN1NPC1RAB9ABLM
SCHEMBL11459733 0.85 KMT2A (0.75) KMT2AMEN1NPC1RAB9ABLM
SCHEMBL6697095 0.84 ALOX15 (0.68) KMT2AMEN1RAB9AALDH1A1ALOX15
SCHEMBL6697101 0.84 ALOX15 (0.68) KMT2AMEN1RAB9AALDH1A1ALOX15
SCHEMBL7632812 0.83 HDAC1 (0.70) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL8325199 0.83 CA12 (0.58) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL7632805 0.83 HDAC1 (0.70) KMT2AMEN1NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111560244-A pH-responsive chitosan fluorescent composite micelle and preparation method and application thereof 安徽工程大学 2020-08-21 — — CN claimed
CN-111560244-B PH responsive chitosan fluorescent composite micelle and preparation method and application thereof 安徽工程大学 2023-08-18 — — CN disclosed
CN-111560244-A pH-responsive chitosan fluorescent composite micelle and preparation method and application thereof 安徽工程大学 2020-08-21 — — CN disclosed
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