SCHEMBL9328656

SCHEMBL9328656

CN(C)c1ccc(C2(c3ccc(NCc4ccccc4)cc3)OC(=O)c3ccccc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.55
ALDH1A1 P00352 4/20 0.55
CYP3A4 P08684 3/20 0.55
HSD17B10 Q99714 3/20 0.55
HPGD P15428 2/20 0.55
HIF1A Q16665 2/20 0.55
CFTR P13569 1/20 0.51
GOPC Q9HD26 1/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47
MAPT P10636 4/20 0.47
LMNA P02545 3/20 0.47
POLB P06746 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ESR1 P03372 1/20 0.47
TP53 P04637 1/20 0.47
TYMS P04818 1/20 0.47
ALOX15 P16050 1/20 0.47

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
SCHEMBL10892627 0.91 CFTR (0.62) TDP1ALDH1A1CYP3A4HSD17B10CFTR
SCHEMBL9328770 0.84 CFTR (0.73) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL50863 0.84 TDP1 (0.75) TDP1ALDH1A1CYP3A4HSD17B10HPGD
Dimethylamine SCHEMBL6656692 0.83 TDP1 (0.69) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL9503404 0.82 TDP1 (0.59) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL10894667 0.78 CFTR (0.61) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL7345587 0.77 HTT (0.63) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL28564000 0.76 TDP1 (0.63) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL29088535 0.75 TDP1 (0.62) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL31376524 0.75 TDP1 (0.62) TDP1ALDH1A1CYP3A4HSD17B10HPGD

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-0376318-B1 Thermosensitive recording member KAO CORP (JP) 1994-03-09 EP disclosed
US-5091356-A Comprising a substrate, a foamed dispersion layer of a self-emulsifiable resin, and a thermosensitive coloring layer containing a developer; stability; colorfastness; intensity KAO CORPORATION (JP) 1992-02-25 US disclosed
EP-0376318-A2 Thermosensitive recording member KAO CORPORATION (JP) 1990-07-04 EP disclosed