SCHEMBL20262120

SCHEMBL20262120

CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4ccc(Br)cc43)cc21

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ CCNE2 O96020 1/20 0.33
▸ CDK4 P11802 1/20 0.33
▸ CCND1 P24385 1/20 0.33
▸ CCNE1 P24864 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ ALK Q9UM73 3/20 0.31
▸ ACHE P22303 1/20 0.31
▸ PGR P06401 4/20 0.31
▸ CAMK2D Q13557 1/20 0.31
▸ TSPO P30536 1/20 0.30

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
SCHEMBL18927683 0.94 TSPO (0.35) PDK2KDM4EATML3MBTL1CCNE2
SCHEMBL15791457 0.93 KDM4E (0.35) PDK2KDM4EATML3MBTL1CCNE2
SCHEMBL30025440 0.93 TSPO (0.37) PDK2KDM4EATML3MBTL1CCNE2
SCHEMBL14822288 0.93 TSPO (0.37) PDK2KDM4EATML3MBTL1CCNE2
SCHEMBL10307239 0.91 KDM4E (0.40) PDK2KDM4EATML3MBTL1CCNE2
SCHEMBL16409619 0.91 KDM4E (0.40) PDK2KDM4EATML3MBTL1PGR
SCHEMBL17038465 0.91 KDM4E (0.40) PDK2KDM4EATML3MBTL1PGR
SCHEMBL13566823 0.89 KDM4E (0.43) PDK2KDM4EATML3MBTL1PGR
SCHEMBL30655846 0.89 KDM4E (0.43) PDK2KDM4EATML3MBTL1PGR
SCHEMBL15791463 0.89 CAMK2D (0.34) PDK2KDM4EATML3MBTL1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108137499-B Amine-based compound and organic light emitting device including the same 株式会社LG化学 2021-07-09 — — CN disclosed
US-10862045-B2 Amine-based compound and organic light-emitting element comprising same LG CHEM, LTD. 2020-12-08 — — US disclosed
EP-3336077-B1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2019-09-11 — — EP disclosed
EP-3336077-B1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2019-09-11 — — EP disclosed
US-20180269401-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-09-20 — — US disclosed
EP-3336077-A2 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG Chem, Ltd. (KR) 2018-06-20 — — EP disclosed
EP-3336077-A2 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG Chem, Ltd. (KR) 2018-06-20 — — EP 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-20180269401-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME EML4, OR10J3, AOC2 PDK2 3349/4885KDM4E 434/4885ATM 181/4885
US-10862045-B2 Amine-based compound and organic light-emitting element comprising same EML4, OR10J3, AOC2 PDK2 3349/4885KDM4E 434/4885ATM 181/4885

“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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