SCHEMBL17322716

SCHEMBL17322716

c1ccc2cc(-c3ccc4ccc5c(-c6cnc7ccccc7c6)ccc6ccc3c4c65)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 3/20 0.49
▸ PDGFRA P16234 3/20 0.49
▸ PIK3CD O00329 2/20 0.46
▸ PIK3CA P42336 2/20 0.46
▸ MET P08581 1/20 0.45
▸ CYP2A6 P11509 1/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ DHFR P00374 1/20 0.43
▸ BIRC5 O15392 1/20 0.43
▸ PIK3CB P42338 1/20 0.43
▸ MTOR P42345 1/20 0.43
▸ PIK3CG P48736 1/20 0.43
▸ PRMT5 O14744 1/20 0.43
▸ WDR77 Q9BQA1 1/20 0.43
▸ TDP2 O95551 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ TOP2A P11388 1/20 0.42

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
SCHEMBL15497847 0.94 PDGFRB (0.54) PDGFRBPDGFRAPIK3CDPIK3CACYP2A6
SCHEMBL16483100 0.91 PDGFRB (0.54) PDGFRBPDGFRAPIK3CDPIK3CAMET
SCHEMBL15497834 0.91 PDGFRB (0.51) PDGFRBPDGFRAPIK3CDPIK3CACYP2A6
SCHEMBL12269130 0.88 PDGFRB (0.51) PDGFRBPDGFRAPIK3CDPIK3CACYP2A6
SCHEMBL16483088 0.85 NPC1 (0.54) PDGFRBPDGFRAPIK3CDPIK3CACYP2A6
SCHEMBL16483458 0.85 PDGFRB (0.51) PDGFRBPDGFRAPIK3CDPIK3CAMET
SCHEMBL19768489 0.84 PDGFRB (0.42) PDGFRBPDGFRAPIK3CDPIK3CAMET
SCHEMBL12268893 0.84 PDGFRB (0.48) PDGFRBPDGFRAPIK3CDPIK3CAMET
SCHEMBL16483096 0.84 PRKCZ (0.49) PDGFRBPDGFRAPIK3CDPIK3CACYP2A6
SCHEMBL15891148 0.84 CYP1A2 (0.44) PDGFRBPDGFRAPIK3CDPIK3CACYP2A6

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-9793489-B2 Pyrene compound and organic light emitting diode device including the same LG DISPLAY CO., LTD. (KR) 2017-10-17 — — US disclosed
US-20150357577-A1 PYRENE COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. 2015-12-10 — — 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-20150357577-A1 PYRENE COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SUN2, PPOX, CYBA PDGFRB 4706/4885PDGFRA 4569/4885PIK3CD 4532/4885

“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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