SCHEMBL8623743

SCHEMBL8623743

CCCCCCCCCCCCCCCCCCNC(=O)NCNC(=O)c1ccc(Sc2ccc(O)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ NAAA Q02083 3/20 0.50
▸ THRA P10827 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ MLYCD O95822 1/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ EPHX1 P07099 5/20 0.46
▸ HDAC3 O15379 5/20 0.46
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC2 Q92769 2/20 0.46
▸ HDAC4 P56524 1/20 0.46
▸ HDAC7 Q8WUI4 1/20 0.46
▸ HDAC10 Q969S8 1/20 0.46
▸ HDAC11 Q96DB2 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46

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
SCHEMBL8388536 0.92 L3MBTL1 (0.60) L3MBTL1NAAATHRATHRBMLYCD
SCHEMBL8392157 0.92 L3MBTL1 (0.60) L3MBTL1NAAATHRATHRBMLYCD
SCHEMBL8625028 0.92 L3MBTL1 (0.60) L3MBTL1NAAATHRATHRBMLYCD
SCHEMBL8391739 0.92 L3MBTL1 (0.60) L3MBTL1NAAATHRATHRBMLYCD
SCHEMBL8388493 0.90 L3MBTL1 (0.64) L3MBTL1NAAATHRATHRBMLYCD
SCHEMBL7197701 0.89 L3MBTL1 (0.56) L3MBTL1NAAATHRATHRBMLYCD
SCHEMBL8624304 0.88 L3MBTL1 (0.51) L3MBTL1NAAAMLYCDMEN1ALDH1A1
SCHEMBL8391696 0.88 ALDH1A1 (0.52) L3MBTL1NAAAMLYCDMEN1ALDH1A1
SCHEMBL7197583 0.85 L3MBTL1 (0.52) L3MBTL1NAAATHRATHRBMLYCD
SCHEMBL7193052 0.85 L3MBTL1 (0.52) L3MBTL1NAAATHRATHRBMLYCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648612-B1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS LTD (JP) 1998-06-10 — — EP disclosed
EP-0648612-A1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1995-04-19 — — EP disclosed
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