SCHEMBL17875730

SCHEMBL17875730

c1ccc2c(c1)oc1cc(-c3ccc4c(c3)CSCc3ccc(-c5cccc6oc7ccccc7c56)cc3-4)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.36
ALOX5 P09917 2/20 0.36
HCRTR1 O43613 1/20 0.35
AHR P35869 2/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
MMP12 P39900 1/20 0.32
MMP13 P45452 1/20 0.32
ATM Q13315 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BACE1 P56817 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
SCHEMBL17875758 1.00 PRKDC (0.36) PRKDCALOX5HCRTR1AHRMEN1
SCHEMBL17875814 0.95 ALOX5 (0.39) PRKDCALOX5HCRTR1AHRMEN1
SCHEMBL17875745 0.94 ALOX5 (0.36) PRKDCALOX5BACE1
SCHEMBL17875741 0.93 ALOX5 (0.36) PRKDCALOX5AHRMEN1KMT2A
SCHEMBL17875759 0.93 ALOX5 (0.36) PRKDCALOX5AHRMEN1KMT2A
SCHEMBL17875727 0.92 AHR (0.40) PRKDCALOX5HCRTR1AHRMEN1
SCHEMBL17875746 0.90 PLA2G2A (0.36) PRKDCALOX5MEN1KMT2AMAPT
SCHEMBL17875762 0.90 PLA2G2A (0.36) PRKDCALOX5MEN1KMT2AMAPT
SCHEMBL17875742 0.90 ALOX5 (0.48) PRKDCALOX5ATMBACE1
SCHEMBL17875724 0.90 ALOX5 (0.48) PRKDCALOX5ATMBACE1

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 PRKDC 4858/4885ALOX5 3059/4885HCRTR1 214/4885
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 PRKDC 4858/4885ALOX5 3059/4885HCRTR1 214/4885

“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.