SCHEMBL4040211

SCHEMBL4040211

COc1ccccc1NCc1ccc2cccc(O)c2n1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ HPGD P15428 1/20 0.49
▸ PTBP1 P26599 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ PDE10A Q9Y233 8/20 0.48
▸ PDE4D Q08499 2/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ ECE2 P0DPD6 1/20 0.45
▸ AGTR1 P30556 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ NSD2 O96028 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PIK3CD O00329 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
SCHEMBL4035492 0.79 KMT2A (0.50) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL7115595 0.76 TP53 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL12834058 0.75 KDM4E (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL14645299 0.73 CA2 (0.68) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL4037167 0.72 NOS1 (0.47) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL4280708 0.71 PDE10A (0.60) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL9471806 0.71 METAP2 (0.49) KMT2AALDH1A1HPGDHTTNPC1
SCHEMBL12593364 0.71 METAP2 (0.49) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL5276192 0.70 HDAC1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL19618931 0.70 MEN1 (0.56) MEN1KMT2AALDH1A1MAPTHPGD

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
CN-101611009-A Quinoline derivatives CHRONOGEN INC (US) 2009-12-23 — — CN claimed
EP-2079699-A1 QUINOLINE DERIVATIVES Envivo Pharmaceuticals, Inc. (US) 2009-07-22 — — EP claimed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 — — WO claimed
CN-101611009-A Quinoline derivatives CHRONOGEN INC (US) 2009-12-23 — — CN disclosed
EP-2079699-A1 QUINOLINE DERIVATIVES Envivo Pharmaceuticals, Inc. (US) 2009-07-22 — — EP disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 — — WO disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 — — WO disclosed
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