SCHEMBL19612784

SCHEMBL19612784

CC1(C)c2cc(B3OC(C)(C)C(C)(C)O3)ccc2-c2ccc(-c3ccncc3)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 11/20 0.46
LPL P06858 10/20 0.46
PDK2 Q15119 1/20 0.39
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
SNCA P37840 1/20 0.34
DGAT1 O75907 1/20 0.34
F11 P03951 1/20 0.33
CTSD P07339 1/20 0.33
BACE1 P56817 1/20 0.33
CDC7 O00311 1/20 0.33
ROCK2 O75116 1/20 0.33
MAP4K4 O95819 1/20 0.33
PRKACA P17612 1/20 0.33
CDK2 P24941 1/20 0.33
GSK3B P49841 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
CYP19A1 P11511 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
SCHEMBL12781865 0.90 LIPG (0.56) LIPGLPLCA1CA2CA9
SCHEMBL1753517 0.90 LIPG (0.50) LIPGLPLCA1CA2CA9
SCHEMBL70387 0.87 LIPG (0.59) LIPGLPLCA1CA2CA9
SCHEMBL429991 0.86 LIPG (0.64) LIPGLPLPDK2CA1CA2
SCHEMBL19716153 0.86 LIPG (0.46) LIPGLPLPDK2CTSDBACE1
SCHEMBL22222575 0.85 LIPG (0.49) LIPGLPLPDK2DGAT1BACE1
SCHEMBL22222520 0.85 LIPG (0.49) LIPGLPLPDK2DGAT1BACE1
SCHEMBL69358 0.84 LIPG (0.47) LIPGLPLCA1CA2CA9
SCHEMBL431646 0.83 LIPG (0.51) LIPGLPLPDK2CA1CA2
SCHEMBL430244 0.83 LIPG (0.51) LIPGLPLPDK2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107400139-B Heterocyclic compound and organic light-emitting device including the same 三星显示有限公司 2021-09-28 CN disclosed
US-10305046-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2019-05-28 US disclosed
US-20170338419-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-23 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-10305046-B2 Heterocyclic compound and organic light-emitting device including the same CYP1A1, CRY1, CCNA1 LIPG 4202/4885LPL 3653/4885PDK2 1820/4885
US-20170338419-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CYP1A1, CRY1, CCNA1 LIPG 4202/4885LPL 3653/4885PDK2 1820/4885

“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.