SCHEMBL17875882

SCHEMBL17875882

c1ccc2c(c1)oc1cccc(-c3ccc4c(c3)-c3cc(-n5c6ccccc6c6ccccc65)ccc3COC4)c12

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
BACE1 P56817 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PRKDC P78527 1/20 0.32
HSP90AA1 P07900 1/20 0.32
EDNRB P24530 1/20 0.30
EDNRA P25101 1/20 0.30

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
SCHEMBL17875852 0.95 HSP90AA1 (0.32) ALOX5BACE1KDM4EATML3MBTL1
SCHEMBL17875817 0.95 HSP90AA1 (0.32) ALOX5BACE1KDM4EATML3MBTL1
SCHEMBL17877776 0.89 TNKS (0.33) PRKDC
SCHEMBL17875775 0.89 ALOX5 (0.32) ALOX5BACE1KDM4EATML3MBTL1
SCHEMBL17875908 0.88 ALOX5 (0.40) ALOX5BACE1KDM4EPRKDCHSP90AA1
SCHEMBL17875880 0.88 ALOX5 (0.48) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL17876282 0.87 FAAH (0.35) ALOX5BACE1KDM4EATML3MBTL1
SCHEMBL17875983 0.87 BACE1 (0.31) ALOX5BACE1PRKDCEDNRBEDNRA
SCHEMBL17875881 0.86 NPC1 (0.38) KDM4EATML3MBTL1PRKDCEDNRB
SCHEMBL17875879 0.86 NPC1 (0.35) KDM4EATML3MBTL1PRKDCHSP90AA1

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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-03-03 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CRY2, CCNE2 ALOX5 3059/4885BACE1 709/4885KDM4E 3120/4885
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 ALOX5 3059/4885BACE1 709/4885KDM4E 3120/4885

“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.