Sugi Predict

Sugi Predict / Compounds / SCHEMBL21168528

SCHEMBL21168528

SCHEMBL21168528

c1ccc(-c2cncc(-c3cccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5c(-c6cccc(-c7cncc(-c8ccccc8)c7)c6)cccc54)c3)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 9/20 0.45
▸ CYP11B1 P15538 2/20 0.39
▸ CYP11B2 P19099 2/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39
▸ MAP3K8 P41279 2/20 0.37
▸ CHRNA7 P36544 1/20 0.37
▸ ATM Q13315 1/20 0.35
▸ PTGER1 P34995 1/20 0.34
▸ PTGER4 P35408 1/20 0.34
▸ PTGER3 P43115 1/20 0.34
▸ PTGER2 P43116 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ HRH3 Q9Y5N1 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
SCHEMBL25222229 0.89 PDK2 (0.41) PDK2ATMPTGER1PTGER4PTGER3
SCHEMBL30257749 0.89 PDK2 (0.41) PDK2ATMPTGER1PTGER4PTGER3
SCHEMBL21168564 0.89 PDK2 (0.41) PDK2CYP11B1CYP11B2MAP3K8HRH3
SCHEMBL24492819 0.88 PDK2 (0.43) PDK2CYP11B1CYP11B2BACE1KCNH2
SCHEMBL22428557 0.86 PDK2 (0.48) PDK2ATMBACE1KCNH2
SCHEMBL24648313 0.85 PDK2 (0.46) PDK2MKNK1BACE1KCNH2HRH3
SCHEMBL22428466 0.85 PDK2 (0.52) PDK2CYP11B1CYP11B2MKNK1MKNK2
SCHEMBL22428481 0.84 PDK2 (0.41) PDK2CYP11B1CYP11B2MKNK1MKNK2
SCHEMBL21168565 0.84 PDK2 (0.42) PDK2CYP11B1CYP11B2
SCHEMBL17031661 0.84 GP6 (0.36) PDK2PTGER1PTGER4PTGER3PTGER2

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-20230126748-A1 POLYMER, A COMPOSITION, AND AN ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-04-27 — — US disclosed
US-20230126748-A1 POLYMER, A COMPOSITION, AND AN ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-04-27 — — US disclosed
US-11233200-B2 Condensed cyclic compound, composition including the same, and organic light-emitting device including the condensed cyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-01-25 — — US disclosed
US-20200212306-A1 QUANTUM DOT ELECTROLUMINESCENCE DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-07-02 — — US disclosed
US-20190221746-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-07-18 — — 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-11233200-B2 Condensed cyclic compound, composition including the same, and organic light-emitting device including the condensed cyclic compound CRY1, CRY2, MCM4 PDK2 2534/4885CYP11B1 1021/4885CYP11B2 1099/4885
US-20190221746-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND CRY1, CRY2, MCM4 PDK2 2534/4885CYP11B1 1021/4885CYP11B2 1099/4885

“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.