SCHEMBL17355405

SCHEMBL17355405

O=C(Nc1ccc(NC(=O)Nc2cccc(NC(=O)Oc3ccccc3)c2)cc1)Nc1cccc(NC(=O)Oc2ccccc2)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.66
ALDH1A1 P00352 6/20 0.64
MAPT P10636 5/20 0.64
KMT2A Q03164 3/20 0.63
RAD51 Q06609 1/20 0.62
KDM4E B2RXH2 2/20 0.60
GAA P10253 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
HTT P42858 1/20 0.59
MEN1 O00255 2/20 0.59
THRB P10828 1/20 0.59
GFER P55789 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
BCHE P06276 1/20 0.58
ACHE P22303 1/20 0.58
RAB9A P51151 2/20 0.58
NPC1 O15118 1/20 0.58
TP53 P04637 3/20 0.57
LMNA P02545 1/20 0.57
SIRT1 Q96EB6 1/20 0.57

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
SCHEMBL13104404 0.94 CA12 (0.61) CYP1A2ALDH1A1MAPTKMT2ARAD51
SCHEMBL14174290 0.93 CYP1A2 (0.62) CYP1A2ALDH1A1MAPTKMT2ARAD51
SCHEMBL8048626 0.92 CYP1A2 (0.76) CYP1A2ALDH1A1MAPTKMT2ARAD51
SCHEMBL13104408 0.92 RAB9A (0.58) CYP1A2ALDH1A1MAPTKMT2ARAD51
SCHEMBL19084910 0.92 CYP1A2 (0.57) CYP1A2ALDH1A1MAPTKMT2ARAD51
SCHEMBL13104410 0.92 SIRT1 (0.68) CYP1A2ALDH1A1MAPTKMT2AMEN1
SCHEMBL17359771 0.90 CYP1A2 (0.56) CYP1A2ALDH1A1MAPTKMT2ARAD51
SCHEMBL18862216 0.89 ALDH1A1 (0.58) CYP1A2ALDH1A1MAPTKMT2ARAD51
SCHEMBL18885469 0.88 CYP1A2 (0.56) CYP1A2ALDH1A1MAPTKMT2ARAD51
SCHEMBL18848299 0.88 CYP1A2 (0.67) CYP1A2ALDH1A1MAPTKMT2ARAD51

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
US-9656498-B2 Heat-sensitive recording body Oji Holdings Corporation (JP) 2017-05-23 US disclosed
US-9656498-B2 Heat-sensitive recording body Oji Holdings Corporation (JP) 2017-05-23 US disclosed
US-20150367663-A1 HEAT-SENSITIVE RECORDING BODY Oji Holdings Corporation (JP) 2015-12-24 US disclosed
US-20150367663-A1 HEAT-SENSITIVE RECORDING BODY Oji Holdings Corporation (JP) 2015-12-24 US disclosed
EP-2957427-A1 HEAT-SENSITIVE RECORDING BODY Oji Holdings Corporation (JP) 2015-12-23 EP disclosed