SCHEMBL14725677

SCHEMBL14725677

c1ccc2c(c1)oc1c2ccc2c(-c3cccc4c3sc3ccccc34)cc3cc4c(cc(-c5cccc6c5sc5ccccc56)c5ccc6c7ccccc7oc6c54)cc3c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.40
PRKDC P78527 11/20 0.40
PIK3CD O00329 2/20 0.40
PIK3CB P42338 2/20 0.40
BRD4 O60885 1/20 0.40
PIK3CA P42336 1/20 0.40
MTOR P42345 1/20 0.40
PIK3CG P48736 1/20 0.40
KCNH2 Q12809 1/20 0.40
BRDT Q58F21 1/20 0.40
PARP14 Q460N5 1/20 0.38
ESR2 Q92731 2/20 0.38
ESR1 P03372 1/20 0.36
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALPI P09923 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL14882922 0.94 PRKDC (0.40) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL16472938 0.93 PRKDC (0.38) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL16472841 0.93 PRKDC (0.38) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL16472879 0.92 PRKDC (0.36) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL16472678 0.92 PRKDC (0.36) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL14725744 0.90 ALOX5 (0.40) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL14725670 0.90 ALOX5 (0.44) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL16472729 0.86 PRKDC (0.35) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL14725772 0.85 ALOX5 (0.44) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL16472824 0.84 ALOX5 (0.40) ALOX5PRKDCPIK3CDPIK3CBBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9255084-B2 Heterocyclic compound and organic light-emitting device containing the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-02-09 US disclosed
US-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-02-28 US disclosed
US-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-02-28 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-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME TRPC1, TRPC4, TRPC6 ALOX5 648/4885PRKDC 4431/4885PIK3CD 1227/4885

“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.