SCHEMBL8024125

SCHEMBL8024125

CNc1ccc2c(c1)-c1cc(NC)ccc1C21OC(=O)c2cc(N(C)C)ccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
HPGD P15428 3/20 0.64
TDP1 Q9NUW8 3/20 0.64
CYP3A4 P08684 2/20 0.64
HIF1A Q16665 1/20 0.64
HSD17B10 Q99714 1/20 0.64
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
FTO Q9C0B1 10/20 0.46
MAPT P10636 4/20 0.37
LMNA P02545 4/20 0.37
HTT P42858 3/20 0.37
NPSR1 Q6W5P4 3/20 0.37
POLB P06746 1/20 0.37
ALOX12 P18054 1/20 0.37
GPR55 Q9Y2T6 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
SMAD3 P84022 1/20 0.37

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
SCHEMBL29381342 0.89 ALDH1A1 (0.79) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL311267 0.89 ALDH1A1 (0.79) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL20335097 0.88 TDP1 (0.80) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL5282818 0.88 TDP1 (0.75) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL19288880 0.87 TDP1 (0.82) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL10690658 0.84 TDP1 (0.64) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL15435609 0.83 HPGD (0.51) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL3506993 0.83 MAPT (0.55) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL13313086 0.83 FTO (0.55) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL10349246 0.80 ALDH1A1 (0.66) ALDH1A1HPGDTDP1CYP3A4HIF1A

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-0754564-B1 Heat sensitive recording material and recording method. MITSUBISHI PAPER MILLS LTD (JP) 2000-03-01 EP disclosed
US-5876898-A MULTICOLOR RECORDING OF HIGH CONTRAST MITSUBISHI PAPER MILLS LIMITED (JP) 1999-03-02 US disclosed
EP-0754564-A2 Heat sensitive recording material and recording method using the same MITSUBISHI PAPER MILLS, LTD. (JP) 1997-01-22 EP disclosed