SCHEMBL16787308

SCHEMBL16787308

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4O5)cc3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.35
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
PDK2 Q15119 1/20 0.32
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
GAA P10253 2/20 0.31
KMT2A Q03164 2/20 0.31
MAPT P10636 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
SCHEMBL16787300 0.99 BACE1 (0.34) BACE1CA12CA9PDK2KDM4E
SCHEMBL16787260 0.97 BACE1 (0.33) BACE1KDM4EMAPT
SCHEMBL15713954 0.94 BACE1 (0.31) BACE1
SCHEMBL16787338 0.89 BACE1 (0.35) BACE1PDK2MAPT
SCHEMBL15713437 0.89 KDM4E (0.32) KDM4EMEN1GAAKMT2AMAPT
SCHEMBL26356890 0.89 PDK2 (0.36) BACE1PDK2KDM4EMEN1KMT2A
SCHEMBL15713439 0.88 KDM4E (0.31) KDM4EMAPT
SCHEMBL21666512 0.88 PDK2 (0.40) BACE1CA12CA9PDK2KDM4E
SCHEMBL15276065 0.87 BACE1 (0.32) BACE1CA12CA9KDM4EMEN1
SCHEMBL16787307 0.87 PDK2 (0.34) BACE1PDK2

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-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE SAMSUNG SDI CO., LTD. (KR) 2015-06-11 US disclosed
US-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE SAMSUNG SDI CO., LTD. (KR) 2015-06-11 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-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE AOX1, ODC1, OR51E2 BACE1 783/4885CA12 3330/4885CA9 2507/4885

“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.