SCHEMBL21973729

SCHEMBL21973729

CC(C)(C)c1ccc(-c2ccc(N(c3ccc(-c4ccc5cc(-c6ccccc6)ccc5c4)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 4/20 0.41
▸ PTGES O14684 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PPARA Q07869 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TSPO P30536 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HDAC4 P56524 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ MDM2 Q00987 1/20 0.34
▸ TNKS O95271 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
SCHEMBL21973970 1.00 PPARG (0.41) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL21973850 0.95 PPARG (0.39) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL24827725 0.95 PPARG (0.39) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL21971354 0.93 KDM4E (0.46) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL16356557 0.93 KDM4E (0.46) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL15138484 0.92 PPARG (0.41) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL13291213 0.91 PTGES (0.38) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL10309968 0.90 KDM4E (0.45) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL13130928 0.90 KDM4E (0.45) PPARGPTGESKDM4EATML3MBTL1
SCHEMBL16356544 0.90 KDM4E (0.46) PPARGPTGESKDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11545630-B2 Compound and organic electroluminescent device comprising the same LG DISPLAY CO., LTD. (KR) 2023-01-03 — — US disclosed
US-20200144509-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME MATERIAL SCIENCE CO., LTD. (KR) 2020-05-07 — — 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-11545630-B2 Compound and organic electroluminescent device comprising the same PIEZO1, KCNN2, ORAI2 PPARG 2139/4885PTGES 2926/4885KDM4E 1244/4885
US-20200144509-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME PIEZO1, KCNN2, HCN2 PPARG 2593/4885PTGES 3726/4885KDM4E 1210/4885

“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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