SCHEMBL16943259

SCHEMBL16943259

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c(-c4ccccc4)c3-c3ccccc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ ATM Q13315 2/20 0.45
▸ KMT2A Q03164 4/20 0.39
▸ PTGER4 P35408 3/20 0.39
▸ NPY5R Q15761 2/20 0.34
▸ IL1R1 P14778 1/20 0.34
▸ MEN1 O00255 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ CTDSP1 Q9GZU7 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ADORA2B P29275 1/20 0.33

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
SCHEMBL20596500 0.96 KDM4E (0.49) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL18676929 0.92 KDM4E (0.38) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL29997093 0.91 KMT2A (0.44) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL29995754 0.91 KDM4E (0.41) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL29996605 0.91 KDM4E (0.41) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL20252100 0.90 L3MBTL1 (0.43) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL20596516 0.90 KDM4E (0.47) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL22058282 0.90 KDM4E (0.47) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL29996529 0.90 PTGER4 (0.40) KDM4EL3MBTL1ATMKMT2APTGER4
SCHEMBL29996436 0.90 L3MBTL1 (0.49) KDM4EL3MBTL1ATMKMT2AIL1R1

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-20210217966-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-07-15 — — US disclosed
US-10991892-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2021-04-27 — — US disclosed
EP-2875019-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2017-03-29 — — EP disclosed
US-20150214489-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-07-30 — — US disclosed
US-20150214489-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-07-30 — — 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 (3 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-20150214489-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MT-CO3, MT-ND3, MT-ND5 KDM4E 2392/4885L3MBTL1 2040/4885ATM 2816/4885
US-20210217966-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MT-CO3, MT-ND3, MT-ND5 KDM4E 2392/4885L3MBTL1 2040/4885ATM 2816/4885
US-10991892-B2 Materials for organic electroluminescent devices MT-CO3, MT-ND3, MT-ND5 KDM4E 2392/4885L3MBTL1 2040/4885ATM 2816/4885

“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.

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