SCHEMBL17482863

SCHEMBL17482863

c1cncc(-c2ccc3c(c2)Oc2ccccc2C32c3ccccc3Oc3cc(-n4c5ccccc5c5cnccc54)ccc32)c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.37
CYP11B2 P19099 9/20 0.36
CYP11B1 P15538 8/20 0.36
MAOA P21397 4/20 0.33
MAOB P27338 4/20 0.33
CYP19A1 P11511 2/20 0.33
CYP17A1 P05093 1/20 0.33
PDK2 Q15119 1/20 0.33
ACHE P22303 1/20 0.33
PGR P06401 1/20 0.32
MAPT P10636 1/20 0.32
KCNH2 Q12809 1/20 0.31
AOC3 Q16853 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
SCHEMBL17482860 0.98 BACE1 (0.36) BACE1CYP11B2CYP11B1MAOAMAOB
SCHEMBL17482850 0.96 BACE1 (0.39) BACE1CYP11B2CYP11B1CYP19A1CYP17A1
SCHEMBL17482875 0.94 BACE1 (0.37) BACE1CYP11B2CYP11B1CYP19A1CYP17A1
SCHEMBL17482857 0.94 MAOA (0.34) BACE1MAOAMAOBACHE
SCHEMBL17482848 0.94 BACE1 (0.38) BACE1CYP11B2CYP11B1CYP19A1CYP17A1
SCHEMBL17482876 0.92 BACE1 (0.36) BACE1CYP11B2CYP11B1CYP19A1CYP17A1
SCHEMBL17482864 0.92 MAOA (0.33) MAOAMAOBACHE
SCHEMBL17482866 0.92 MAOA (0.34) MAOAMAOBACHE
SCHEMBL17482865 0.92 BACE1 (0.35) BACE1CYP11B2CYP11B1PDK2MAPT
SCHEMBL17482855 0.89 BACE1 (0.36) BACE1CYP11B2CYP11B1CYP19A1CYP17A1

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-20160035986-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-02-04 US disclosed
US-20160035986-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-02-04 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-20160035986-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, CCNA1 BACE1 533/4885CYP11B2 1724/4885CYP11B1 975/4885

“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.