Sugi Predict

Sugi Predict / Compounds / SCHEMBL21730725

SCHEMBL21730725

SCHEMBL21730725

C=Cc1ccc(-c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3-c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)cc4)cc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 16/20 0.40
▸ HDAC2 Q92769 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ APAF1 O14727 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ XBP1 P17861 1/20 0.31
▸ PTBP1 P26599 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ GALK1 P51570 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ SMAD3 P84022 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL22891864 0.95 PDK2 (0.39) PDK2HDAC2
SCHEMBL21730815 0.93 PDK2 (0.36) PDK2HDAC2
SCHEMBL21730723 0.93 PDK2 (0.36) PDK2HDAC2
SCHEMBL21730593 0.93 PDK2 (0.36) PDK2HDAC2
SCHEMBL21895082 0.92 MEN1 (0.35) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL21730623 0.91 PDK2 (0.34) PDK2HDAC2
SCHEMBL23134185 0.91 PDK2 (0.38) PDK2HDAC2
SCHEMBL21730597 0.90 PDK2 (0.34) PDK2
SCHEMBL24993750 0.90 PDK2 (0.39) PDK2
SCHEMBL21217299 0.90 MEN1 (0.36) PDK2ALDH1A1TSHRMEN1LMNA

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
EP-3763750-B1 POLYMER, MONOMER, COATING COMPOSITION COMPRISING SAME, AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG CHEMICAL LTD (KR) 2023-07-19 — — EP disclosed
US-11706970-B2 Polymer, coating composition comprising same, and organic light emitting device using same LG CHEM, LTD. 2023-07-18 — — US disclosed
US-11706970-B2 Polymer, coating composition comprising same, and organic light emitting device using same LG CHEM, LTD. 2023-07-18 — — US disclosed
US-20210175427-A1 Polymer, Coating Composition Comprising Same, and Organic Light Emitting Device Using Same LG CHEM, LTD. (KR) 2021-06-10 — — US disclosed
WO-2020036459-A1 POLYMER, COATING COMPOSITION COMPRISING SAME, AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-02-20 — — WO 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-11706970-B2 Polymer, coating composition comprising same, and organic light emitting device using same CRY1, GPS1, SEM1 PDK2 3132/4885HDAC2 2650/4885ALDH1A1 80/4885
US-20210175427-A1 Polymer, Coating Composition Comprising Same, and Organic Light Emitting Device Using Same CRY1, GPS1, SEM1 PDK2 3174/4885HDAC2 3263/4885ALDH1A1 81/4885

“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.