SCHEMBL13615759

SCHEMBL13615759

c1ccc(N(c2ccccc2)c2ccc(-c3c4ccc(N(c5ccccc5)c5ccc(-c6cccc7ccccc67)cc5)cc4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4ccc(N(c5ccccc5)c5ccc(-c6cccc7ccccc67)cc5)cc34)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.43
ACMSD Q8TDX5 1/20 0.43
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA9 Q16790 3/20 0.39
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
PPARG P37231 9/20 0.38
PPARA Q07869 9/20 0.38
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
PPARD Q03181 1/20 0.37
ENPP3 O14638 1/20 0.37
ENPP1 P22413 1/20 0.37
CYP1A2 P05177 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
TNF P01375 1/20 0.36

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
SCHEMBL13333512 0.94 MCL1 (0.39) MCL1ACMSDCA12CA1CA2
SCHEMBL26335905 0.93 MCL1 (0.42) MCL1ACMSDCA12CA1CA2
SCHEMBL10063918 0.93 CA12 (0.44) MCL1ACMSDCA12CA1CA2
SCHEMBL13333571 0.92 MCL1 (0.38) MCL1ACMSDCA12CA1CA2
SCHEMBL26335901 0.92 MCL1 (0.42) MCL1ACMSDCA12CA1CA2
SCHEMBL13333755 0.92 MCL1 (0.39) MCL1ACMSDCA12CA1CA2
SCHEMBL12928335 0.92 MCL1 (0.38) MCL1ACMSDCA12CA1CA2
SCHEMBL26335933 0.92 CA12 (0.43) MCL1ACMSDCA12CA1CA2
SCHEMBL15762780 0.92 MCL1 (0.38) MCL1ACMSDCA12CA1CA2
SCHEMBL14099688 0.92 MCL1 (0.38) MCL1ACMSDCA12CA1CA2

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-20090273277-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 US disclosed
US-20090273277-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 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-20090273277-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, ORMDL3, CHRM2 MCL1 1848/4885ACMSD 404/4885CA12 4014/4885

“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.