SCHEMBL13642985

SCHEMBL13642985

N#Cc1ccc(-c2cc(-c3ccc4c5ccccc5c5ccccc5c4c3)c3cc(-c4ccc5c6ccccc6c6ccccc6c5c4)c4ccccc4c3n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.43
▸ ABCB1 P08183 1/20 0.43
▸ MYC P01106 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ ACP1 P24666 1/20 0.40
▸ GABRA1 P14867 1/20 0.40
▸ GABRG2 P18507 1/20 0.40
▸ GABRB3 P28472 1/20 0.40
▸ GABRA5 P31644 1/20 0.40
▸ GABRA3 P34903 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PDPK1 O15530 1/20 0.37
▸ ALDH1A3 P47895 1/20 0.37
▸ AR P10275 1/20 0.37
▸ TGFBR1 P36897 1/20 0.37
▸ SQOR Q9Y6N5 1/20 0.37
▸ PARP1 P09874 1/20 0.36
▸ PARP2 Q9UGN5 1/20 0.36

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
SCHEMBL13084046 0.99 ABCG2 (0.42) ABCG2ABCB1MYCMAOBACP1
SCHEMBL13083960 0.96 ABCG2 (0.40) ABCG2ABCB1MYCMAOBACP1
SCHEMBL13083915 0.96 ABCG2 (0.40) ABCG2ABCB1MYCMAOBACP1
SCHEMBL13642848 0.95 ABCG2 (0.39) ABCG2ABCB1MYCMAOBACP1
SCHEMBL13083918 0.95 ABCG2 (0.39) ABCG2ABCB1MYCMAOBACP1
SCHEMBL13642866 0.89 ABCG2 (0.51) ABCG2ABCB1MYCACP1GABRA1
SCHEMBL13643003 0.89 ABCG2 (0.51) ABCG2ABCB1MYCACP1GABRA1
SCHEMBL13643179 0.89 ABCG2 (0.51) ABCG2ABCB1MYCACP1GABRA1
SCHEMBL13644436 0.88 XDH (0.42) MAOBGABRA1GABRG2GABRB3GABRA5
SCHEMBL13642847 0.88 XDH (0.42) MAOBGABRA1GABRG2GABRB3GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796917-B2 Compound for an organic optoelectronic device, organic light emitting diode including the same, and display including the organic light emitting diode CHEIL INDUSTRIES, INC (KR) 2014-08-05 — — US disclosed
US-8796917-B2 Compound for an organic optoelectronic device, organic light emitting diode including the same, and display including the organic light emitting diode CHEIL INDUSTRIES, INC (KR) 2014-08-05 — — US disclosed
US-20120280613-A1 COMPOUND FOR AN ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME, AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2012-11-08 — — US disclosed
US-20120280613-A1 COMPOUND FOR AN ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME, AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2012-11-08 — — 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-20120280613-A1 COMPOUND FOR AN ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME, AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE OR51E2, AOX1, OR10J3 ABCG2 2864/4885ABCB1 905/4885MYC 1711/4885

“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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