SCHEMBL19655358

SCHEMBL19655358

c1ccc2c(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3cnc4c5ccccc5c5ccccc5c4n3)cccc2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.34
GSR P00390 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
ALDH1A1 P00352 5/20 0.32
NPC1 O15118 1/20 0.32
MAPK1 P28482 1/20 0.32
KDM4E B2RXH2 2/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
PI4KA P42356 1/20 0.32
PI4K2B Q8TCG2 1/20 0.32
PI4K2A Q9BTU6 1/20 0.32
PI4KB Q9UBF8 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
HPGD P15428 3/20 0.31
MEN1 O00255 1/20 0.31
APAF1 O14727 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL19655145 0.89 KDM4E (0.35) KDM4E
SCHEMBL19653818 0.88 TDP1 (0.34) TDP1GSRCNR1CNR2ALDH1A1
SCHEMBL19655241 0.86 TDP1 (0.38) TDP1GSRCNR1CNR2ALDH1A1
SCHEMBL19655304 0.84 MAPT (0.39) TDP1GSRCNR1CNR2ALDH1A1
SCHEMBL19655335 0.83 KDM4E (0.49) ALDH1A1MAPK1KDM4EHTTHPGD
SCHEMBL19655347 0.83 ALOX5 (0.32) MAPT
SCHEMBL19655345 0.83 DRD4 (0.30) MAPK1
SCHEMBL19655357 0.81 ALDH1A1 (0.36) CNR1CNR2ALDH1A1NPC1KDM4E
SCHEMBL19655377 0.81 KDM4E (0.33) KDM4E
SCHEMBL126285 0.81 ALDH1A1 (0.44) TDP1GSRCNR1CNR2ALDH1A1

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
US-10840458-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2020-11-17 US disclosed
US-20170346022-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-11-30 US disclosed
US-20170346022-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-11-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170346022-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES PDXK, MT-ND4L, PNPO TDP1 2427/4885GSR 545/4885CNR1 3605/4885
US-10840458-B2 Organic electroluminescent materials and devices PDXK, MT-ND4L, PNPO TDP1 2427/4885GSR 545/4885CNR1 3605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.