SCHEMBL10331522

SCHEMBL10331522

c1ccc(-n2c(-c3ccc(-n4c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)cc3)cc3ccccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ ATM Q13315 1/20 0.51
▸ HAO1 Q9UJM8 1/20 0.47
▸ APP P05067 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.41
▸ TSHR P16473 2/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ PTGER4 P35408 1/20 0.38
▸ HDAC4 P56524 1/20 0.37
▸ RAC2 P15153 1/20 0.36
▸ RAC3 P60763 1/20 0.36
▸ CDC42 P60953 1/20 0.36
▸ RAC1 P63000 1/20 0.36
▸ KCNH2 Q12809 1/20 0.35
▸ AOC3 Q16853 1/20 0.35
▸ IL1R1 P14778 1/20 0.35
▸ TSPO P30536 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 1/20 0.34

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
SCHEMBL10331523 0.91 L3MBTL1 (0.47) L3MBTL1KDM4EATMHAO1APP
SCHEMBL9886116 0.90 HAO1 (0.53) L3MBTL1KDM4EATMHAO1APP
SCHEMBL3871381 0.90 HAO1 (0.53) L3MBTL1KDM4EATMHAO1APP
SCHEMBL15887972 0.88 KDM4E (0.48) L3MBTL1KDM4EATMHAO1APP
SCHEMBL3861466 0.87 HAO1 (0.51) L3MBTL1KDM4EATMHAO1APP
SCHEMBL13645511 0.87 HAO1 (0.51) L3MBTL1KDM4EATMHAO1APP
SCHEMBL15435755 0.86 L3MBTL1 (0.69) L3MBTL1KDM4EATMALDH1A1KMT2A
SCHEMBL10331646 0.86 L3MBTL1 (0.69) L3MBTL1KDM4EATMALDH1A1KMT2A
SCHEMBL23264319 0.85 KDM4E (0.55) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL23264323 0.85 KDM4E (0.55) L3MBTL1KDM4EATMALDH1A1TSHR

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-9382206-B2 Nitrogen-containing aromatic heterocyclic derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2016-07-05 — — US disclosed
US-9382206-B2 Nitrogen-containing aromatic heterocyclic derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2016-07-05 — — US disclosed
US-20140306207-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, AND MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-10-16 — — US disclosed
US-20120181524-A1 NITROGEN-CONTAINING AROMATIC HETEROCYCLIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-07-19 — — US disclosed
US-20120181524-A1 NITROGEN-CONTAINING AROMATIC HETEROCYCLIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-07-19 — — 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 (1 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-20120181524-A1 NITROGEN-CONTAINING AROMATIC HETEROCYCLIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME AOC3, NPR3, NR0B1 L3MBTL1 4455/4885KDM4E 3595/4885ATM 2952/4885

“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.

Send feedback