SCHEMBL8624976

SCHEMBL8624976

CCCCCCCCCCSCCCCCCCCCCCNC(=O)NNC(=O)c1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ ESR1 P03372 1/20 0.50
▸ ESR2 Q92731 1/20 0.50
▸ NAAA Q02083 3/20 0.49
▸ HDAC1 Q13547 5/20 0.48
▸ HDAC2 Q92769 5/20 0.48
▸ HDAC3 O15379 4/20 0.48
▸ MLYCD O95822 1/20 0.47
▸ EPHX1 P07099 3/20 0.47
▸ HTT P42858 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HDAC11 Q96DB2 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ LMNA P02545 1/20 0.45

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
SCHEMBL8389301 0.92 ALDH1A1 (0.60) ALDH1A1L3MBTL1NAAAHDAC1HDAC2
SCHEMBL8391654 0.92 ALDH1A1 (0.60) ALDH1A1L3MBTL1NAAAHDAC1HDAC2
SCHEMBL8621081 0.92 ALDH1A1 (0.60) ALDH1A1L3MBTL1NAAAHDAC1HDAC2
SCHEMBL8623286 0.92 ALDH1A1 (0.60) ALDH1A1L3MBTL1NAAAHDAC1HDAC2
SCHEMBL8626004 0.90 L3MBTL1 (0.51) ALDH1A1L3MBTL1ESR1ESR2NAAA
SCHEMBL8621512 0.89 L3MBTL1 (0.64) ALDH1A1L3MBTL1ESR1ESR2NAAA
SCHEMBL7198042 0.88 ALDH1A1 (0.56) ALDH1A1L3MBTL1NAAAHDAC1HDAC2
SCHEMBL8391696 0.87 ALDH1A1 (0.52) ALDH1A1L3MBTL1NAAAHDAC1HDAC2
SCHEMBL7194345 0.85 HDAC3 (0.54) ALDH1A1L3MBTL1NAAAHDAC1HDAC2
SCHEMBL7743637 0.85 HDAC3 (0.54) ALDH1A1L3MBTL1NAAAHDAC1HDAC2

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
EP-0648612-B1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS LTD (JP) 1998-06-10 — — EP disclosed
US-5498772-A SUBSTRATE WITH HEAT SENSITIVE LAYER AND OPTICAL RECORDING LAYER MITSUBISHI PAPER MILLS LIMITED (JP) 1996-03-12 — — US disclosed
EP-0648612-A1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1995-04-19 — — EP disclosed
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