SCHEMBL13820437

SCHEMBL13820437

c1cncc(-c2cc3ccccc3c3cc4c(-c5ccc(-n6c7ccccc7c7cc8c(cc76)sc6ccccc68)cc5)c5ccccc5c(-c5ccc(-n6c7ccccc7c7cc8c(cc76)sc6ccccc68)cc5)c4cc23)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 13/20 0.45
GPR84 Q9NQS5 1/20 0.36
CYP11B2 P19099 12/20 0.33
HIPK2 Q9H2X6 1/20 0.32
MAPT P10636 2/20 0.31
KCNH2 Q12809 1/20 0.31
AOC3 Q16853 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 1/20 0.30
ALOX5 P09917 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
SCHEMBL13820355 0.90 KDM4E (0.33) ALOX5
SCHEMBL16472899 0.85 CYP11B1 (0.42) CYP11B1GPR84CYP11B2HIPK2MAPT
SCHEMBL16472895 0.85 CYP11B1 (0.42) CYP11B1GPR84CYP11B2HIPK2MAPT
SCHEMBL13820440 0.82 CYP11B1 (0.45) CYP11B1GPR84CYP11B2HIPK2MAPT
SCHEMBL15681305 0.81 L3MBTL1 (0.42) MAPTRAB9A
SCHEMBL13820431 0.80 CYP11B1 (0.42) CYP11B1GPR84CYP11B2MAPT
SCHEMBL13820580 0.79 KDM4E (0.32)
SCHEMBL16472912 0.79 KDM4E (0.35) CYP11B2MAPTKCNH2AOC3NPC1
SCHEMBL21180543 0.77 L3MBTL1 (0.40) MAPTRAB9AALOX5
SCHEMBL21180579 0.77 L3MBTL1 (0.40) MAPTRAB9AALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120286251-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2012-11-15 US disclosed
US-20120286251-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2012-11-15 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 (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-20120286251-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, LEF1, OR51E2 CYP11B1 613/4885GPR84 1320/4885CYP11B2 829/4885

“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.