SCHEMBL17704029

SCHEMBL17704029

N#Cc1ccc(-n2c3ccc(C#N)cc3c3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4O5)ccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.32
▸ PIK3CD O00329 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ USP14 P54578 1/20 0.31
▸ ABCC9 O60706 1/20 0.31
▸ MDM4 O15151 1/20 0.30
▸ MDM2 Q00987 1/20 0.30
▸ USP2 O75604 1/20 0.30

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
SCHEMBL17704007 0.97 PDK2 (0.32) PDK2PIK3CDPIK3CAABCC9
SCHEMBL17704006 0.97 G6PD (0.32) PDK2ABCC9
SCHEMBL17704028 0.94 PIK3CD (0.36) PDK2PIK3CDPIK3CA
SCHEMBL17704059 0.92 TNKS2 (0.32) ABCC9
SCHEMBL17703997 0.92 — —
SCHEMBL17703993 0.91 PDK2 (0.31) PDK2ABCC9
SCHEMBL17703226 0.91 MDM4 (0.32) PIK3CDPIK3CAMDM4MDM2
SCHEMBL17703208 0.91 G6PD (0.32) —
SCHEMBL17704030 0.89 LMNA (0.35) ABCC9
SCHEMBL17703206 0.89 PIK3CD (0.31) PIK3CDPIK3CAUSP14ABCC9

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-9722187-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-08-01 — — US disclosed
US-20160118599-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-28 — — 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 (1 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-20160118599-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, AOX1, CYP1A1 PDK2 2140/4885PIK3CD 4534/4885PIK3CA 4374/4885

“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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