SCHEMBL16943252

SCHEMBL16943252

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3)n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.55
▸ ATM Q13315 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ AVPR1A P37288 1/20 0.44
▸ KMT2A Q03164 5/20 0.40
▸ MEN1 O00255 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ IL1R1 P14778 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ RXRA P19793 1/20 0.38
▸ RXRB P28702 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ PTGER4 P35408 1/20 0.37
▸ PRMT5 O14744 1/20 0.36

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
SCHEMBL17714941 0.98 L3MBTL1 (0.53) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL15197775 0.98 L3MBTL1 (0.53) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL21472258 0.97 ATM (0.50) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL22386906 0.97 ATM (0.50) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL14749002 0.97 L3MBTL1 (0.55) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL24273038 0.97 L3MBTL1 (0.55) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL24273018 0.97 L3MBTL1 (0.55) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL24065299 0.97 ATM (0.50) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL22386989 0.97 ATM (0.50) L3MBTL1ATMKDM4EAVPR1AKMT2A
SCHEMBL23263473 0.97 ATM (0.50) L3MBTL1ATMKDM4EAVPR1AKMT2A

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 9 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
US-10593886-B2 OLED devices with improved lifetime using non-crystallizable molecular glass mixture hosts MOLECULAR GLASSES, INC. (US) 2020-03-17 — — US disclosed
US-20190074467-A1 SOLVENT COATABLE OLED EMITTER COMPOSITION CONTAINING NON-PLASMONIC MOLECULAR NOBLE METAL NANOPARTICLES AND EMITTER MATERIALS IN NONCRYSTALLIZABLE MOLECULAR ORGANIC SEMICONDUCTORS MOLECULAR GLASSES, INC. (US) 2019-03-07 — — US disclosed
US-20170237004-A1 OLED DEVICES WITH IMPROVED LIFETIME USING NON-CRYSTALLIZABLE MOLECULAR GLASS MIXTURE HOSTS MOLECULAR GLASSES, INC. (US) 2017-08-17 — — US disclosed
US-20170237004-A1 OLED DEVICES WITH IMPROVED LIFETIME USING NON-CRYSTALLIZABLE MOLECULAR GLASS MIXTURE HOSTS MOLECULAR GLASSES, INC. (US) 2017-08-17 — — 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 L3MBTL1 2040/4885ATM 2816/4885KDM4E 2392/4885
US-20210217966-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MT-CO3, MT-ND3, MT-ND5 L3MBTL1 2040/4885ATM 2816/4885KDM4E 2392/4885
US-10991892-B2 Materials for organic electroluminescent devices MT-CO3, MT-ND3, MT-ND5 L3MBTL1 2040/4885ATM 2816/4885KDM4E 2392/4885

“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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