SCHEMBL9973744

SCHEMBL9973744

c1cncc(-c2cc(-c3ncc(-c4ccc(-c5cnc(-c6ccnc(-c7cccnc7)c6)o5)cc4)o3)ccn2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.66
ALDH1A1 P00352 4/20 0.66
HPGD P15428 4/20 0.66
RAB9A P51151 4/20 0.66
NPC1 O15118 3/20 0.66
HSD17B10 Q99714 3/20 0.66
SMN1; SMN2 Q16637 3/20 0.59
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
CASP1 P29466 1/20 0.53
CYP2A6 P11509 2/20 0.51
HSD17B1 P14061 1/20 0.50
HSD17B2 P37059 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TP53 P04637 2/20 0.49
GAA P10253 2/20 0.49
STAT1 P42224 1/20 0.49
LOXL2 Q9Y4K0 1/20 0.48
S1PR1 P21453 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
SCHEMBL9973745 0.87 KDM4E (0.56) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL9973718 0.82 KDM4E (0.60) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL4881571 0.80 RAB9A (1.00) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL9973722 0.79 RAB9A (0.64) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL9973690 0.78 RAB9A (0.63) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL1760672 0.78 CYP2A6 (0.68) ALDH1A1CYP2A6MEN1LOXL2CYP1A2
SCHEMBL6756761 0.78 RAB9A (0.77) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL3194240 0.78 RAB9A (0.77) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL4882352 0.77 KDM4E (0.61) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL4882549 0.77 RAB9A (0.87) KDM4EALDH1A1HPGDRAB9ANPC1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202633-B2 Electron transport material and organic electroluminescent device using the same JNC CORPORATION (JP) 2012-06-19 US disclosed
US-8202633-B2 Electron transport material and organic electroluminescent device using the same JNC CORPORATION (JP) 2012-06-19 US disclosed
US-20110215310-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SK MATERIALS JNC CO., LTD. (KR) 2011-09-08 US disclosed
US-20110215310-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SK MATERIALS JNC CO., LTD. (KR) 2011-09-08 US disclosed
US-7964293-B2 Electron transport material and organic electroluminescent device using the same JNC CORPORATION (JP) 2011-06-21 US disclosed
US-7964293-B2 Electron transport material and organic electroluminescent device using the same JNC CORPORATION (JP) 2011-06-21 US disclosed
US-20090134780-A1 Electron transport material and organic electroluminescent device using the same SK MATERIALS JNC CO., LTD. (KR) 2009-05-28 US disclosed
US-20090134780-A1 Electron transport material and organic electroluminescent device using the same SK MATERIALS JNC CO., LTD. (KR) 2009-05-28 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-20110215310-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SLC25A11, ELAVL1, SLC26A3 KDM4E 1968/4885ALDH1A1 2928/4885HPGD 2129/4885
US-20090134780-A1 Electron transport material and organic electroluminescent device using the same SLC25A11, ELAVL1, SLC26A3 KDM4E 1968/4885ALDH1A1 2928/4885HPGD 2129/4885

“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.