SCHEMBL17875728

SCHEMBL17875728

c1cncc(-c2cc(-c3cccnc3)cc(-c3ccc4c(c3)-c3ccc(-c5cccc6c5oc5ccccc56)cc3CSC4)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.42
CYP11B1 P15538 6/20 0.37
CYP11B2 P19099 6/20 0.37
CYP1A2 P05177 3/20 0.37
TDP2 O95551 2/20 0.37
PRKDC P78527 4/20 0.36
PGR P06401 1/20 0.35
GGPS1 O95749 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PDK2 Q15119 1/20 0.34
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
CYP19A1 P11511 1/20 0.33
PTGES2 Q9H7Z7 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
SCHEMBL17875767 1.00 ALOX5 (0.42) ALOX5CYP11B1CYP11B2CYP1A2TDP2
SCHEMBL17875793 0.96 ALOX5 (0.45) ALOX5CYP11B1CYP11B2CYP1A2TDP2
SCHEMBL17875756 0.90 CYP11B1 (0.38) CYP11B1CYP11B2CYP1A2TDP2PRKDC
SCHEMBL17875760 0.90 CYP11B1 (0.38) CYP11B1CYP11B2CYP1A2TDP2PRKDC
SCHEMBL17875726 0.89 ALOX5 (0.47) ALOX5PRKDCGGPS1PRMT5WDR77
SCHEMBL17875747 0.89 ALOX5 (0.47) ALOX5PRKDCGGPS1PRMT5WDR77
SCHEMBL17875737 0.88 CYP11B1 (0.40) CYP11B1CYP11B2CYP1A2TDP2PGR
SCHEMBL17875764 0.88 CYP11B1 (0.40) CYP11B1CYP11B2CYP1A2TDP2PGR
SCHEMBL17875753 0.88 CYP11B1 (0.40) CYP11B1CYP11B2CYP1A2TDP2PGR
SCHEMBL17875797 0.88 CYP11B1 (0.40) CYP11B1CYP11B2CYP1A2TDP2PGR

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 3059/4885CYP11B1 938/4885CYP11B2 1374/4885
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 ALOX5 3059/4885CYP11B1 938/4885CYP11B2 1374/4885

“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.