SCHEMBL18961972

SCHEMBL18961972

c1ccc2c(c1)oc1c(-c3cccc4c3sc3ccccc34)nc(-n3c4ccccc4c4cc5c(cc43)sc3ccccc35)nc12

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 8/20 0.34
PIK3CD O00329 2/20 0.34
PIK3CB P42338 2/20 0.34
BRD4 O60885 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
KCNH2 Q12809 1/20 0.33
BRDT Q58F21 1/20 0.33
ALOX5 P09917 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 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
SCHEMBL18961944 0.96 PRKDC (0.34) PRKDCPIK3CDPIK3CBBRD4PIK3CA
SCHEMBL21735958 0.92 PRKDC (0.35) PRKDCPIK3CDPIK3CBBRD4PIK3CA
SCHEMBL18961971 0.92 NPC1 (0.30)
SCHEMBL18962018 0.92 ALOX5 (0.33) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL18962024 0.88 ALOX5 (0.33) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL18962067 0.88 CREBBP (0.32)
SCHEMBL23026922 0.88 PRKDC (0.33) PRKDCPIK3CDPIK3CBBRD4PIK3CA
SCHEMBL18961973 0.87 MAPT (0.36) KDM4EMEN1ALDH1A1KMT2A
SCHEMBL18961909 0.86 PRKDC (0.32) PRKDCPIK3CDPIK3CBBRD4PIK3CA
SCHEMBL18962021 0.86 PRKDC (0.36) PRKDCPIK3CDPIK3CBBRD4PIK3CA

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-10011608-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-07-03 US disclosed
US-10011608-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-07-03 US disclosed
US-20170166581-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2017-06-15 US disclosed
US-20170166581-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2017-06-15 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-10011608-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof PIEZO1, OR51E2, OCIAD1 PRKDC 4031/4885PIK3CD 4095/4885PIK3CB 4416/4885
US-20170166581-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF PIEZO1, OR51E2, OCIAD1 PRKDC 4031/4885PIK3CD 4095/4885PIK3CB 4416/4885

“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.