SCHEMBL21628353

SCHEMBL21628353

CC1(C)OB(c2cc(C#N)cc(-c3ccccc3)c2)OC1(C)C

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 9/20 0.57
▸ LPL P06858 8/20 0.57
▸ ESR2 Q92731 1/20 0.36
▸ CYP19A1 P11511 1/20 0.36
▸ DGAT1 O75907 1/20 0.36
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ P4HB P07237 1/20 0.35
▸ PGR P06401 4/20 0.34
▸ MYC P01106 1/20 0.34
▸ TSHR P16473 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
SCHEMBL20870643 0.96 LIPG (0.53) LIPGLPLESR2CYP19A1PGR
SCHEMBL31625405 0.90 LIPG (0.59) LIPGLPLESR2DGAT1MYC
SCHEMBL23020133 0.90 LIPG (0.44) LIPGLPLPGR
SCHEMBL21302784 0.90 LIPG (0.46) LIPGLPLESR2CYP19A1PGR
SCHEMBL17714867 0.88 LPL (0.47) LIPGLPLDGAT1TSHR
SCHEMBL32682796 0.88 LPL (0.47) LIPGLPLDGAT1TSHR
SCHEMBL24443047 0.86 LIPG (0.43) LIPGLPLESR2DGAT1PGR
SCHEMBL23705320 0.86 LPL (0.40) LIPGLPLESR2PGR
SCHEMBL23020080 0.85 LIPG (0.44) LIPGLPLESR2DGAT1PGR
SCHEMBL16419786 0.84 LIPG (0.72) LIPGLPLDGAT1P4HB

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
EP-3597645-B1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND SAMSUNG ELECTRONICS CO LTD (KR) 2024-05-08 — — EP disclosed
CN-110734418-B Condensed-cyclic compound, composition including the same, and organic light-emitting device 三星电子株式会社 2024-01-26 — — CN disclosed
US-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-07-06 — — US disclosed
US-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-07-06 — — US disclosed
CN-110734418-A Fused ring compound, and composition and organic light-emitting device including same 三星电子株式会社 2020-01-31 — — CN disclosed
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND SAMSUNG SDI CO., LTD. (KR) 2020-01-30 — — US disclosed
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND SAMSUNG SDI CO., LTD. (KR) 2020-01-30 — — 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 (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-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound CCNL2, ARL1, CRY1 LIPG 3269/4885LPL 1393/4885ESR2 77/4885
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND CCNL2, ARL1, CRY1 LIPG 3269/4885LPL 1393/4885ESR2 77/4885

“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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