SCHEMBL5282818

SCHEMBL5282818

CNc1ccc2c(c1)C(=O)OC2(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.75
ALDH1A1 P00352 2/20 0.75
CYP3A4 P08684 2/20 0.75
HSD17B10 Q99714 2/20 0.75
HPGD P15428 1/20 0.75
HIF1A Q16665 1/20 0.75
MEN1 O00255 3/20 0.68
KMT2A Q03164 3/20 0.68
FTO Q9C0B1 4/20 0.43
CFTR P13569 1/20 0.41
GOPC Q9HD26 1/20 0.41
LMNA P02545 3/20 0.40
POLB P06746 2/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ESR1 P03372 1/20 0.40
TP53 P04637 1/20 0.40
TYMS P04818 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL19288880 0.94 TDP1 (0.82) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL20335097 0.92 TDP1 (0.80) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL7162246 0.88 TDP1 (0.73) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL8024125 0.88 ALDH1A1 (0.64) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL11504084 0.86 TDP1 (0.70) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL27188 0.86 ALDH1A1 (1.00) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL18143522 0.86 ALDH1A1 (1.00) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL221163 0.85 TDP1 (0.81) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL10690658 0.83 TDP1 (0.64) TDP1ALDH1A1CYP3A4HSD17B10HPGD
SCHEMBL12152338 0.82 ALDH1A1 (0.81) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013037672-A1 COLOUR LASER MARKING METHODS OF SECURITY DOCUMENT PRECURSORS AGFA-GEVAERT (BE) 2013-03-21 WO disclosed
WO-2012076488-A1 COLOUR LASER MARKING METHODS OF SECURITY DOCUMENT PRECURSORS AGFA-GEVAERT (BE) 2012-06-14 WO disclosed
EP-1865382-A1 Method for preparation of lithographic printing plate and lithographic printing plate FUJIFILM Corporation (JP) 2007-12-12 EP disclosed
US-20060154818-A1 Polymeric material containing a latent acid CIBA SPECIALTY CHEMICAL CORP. 2006-07-13 US disclosed
US-4471074-A Heat-sensitive recording materials FUJI PHOTO FILM CO., LTD. (JP) 1984-09-11 US disclosed