SCHEMBL13298541

SCHEMBL13298541

c1ccc([SiH2]c2ccc3c(-c4cccc(-c5cccc6ccccc56)c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.38
▸ ACMSD Q8TDX5 1/20 0.38
▸ HDAC4 P56524 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ GPR84 Q9NQS5 1/20 0.36
▸ PIM1 P11309 2/20 0.36
▸ ADORA2A P29274 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ GSTP1 P09211 1/20 0.35
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ PPARG P37231 5/20 0.33
▸ PPARA Q07869 5/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 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
SCHEMBL13298546 1.00 MCL1 (0.38) MCL1ACMSDHDAC4HDAC2HDAC8
SCHEMBL13298582 0.95 PIM1 (0.36) MCL1ACMSDHDAC4HDAC2HDAC8
SCHEMBL13298587 0.95 PIM1 (0.36) MCL1ACMSDHDAC4HDAC2HDAC8
SCHEMBL13298549 0.94 HSD17B1 (0.35) MCL1ACMSDHDAC4HDAC2HDAC8
SCHEMBL13298555 0.94 HSD17B1 (0.35) MCL1ACMSDHDAC4HDAC2HDAC8
SCHEMBL13298505 0.94 PPARG (0.36) MCL1ACMSDHDAC4HDAC2HDAC8
SCHEMBL13298499 0.94 PPARG (0.36) MCL1ACMSDHDAC4HDAC2HDAC8
SCHEMBL13298542 0.91 MCL1 (0.37) MCL1ACMSDALDH1A1MAPTCA12
SCHEMBL13298545 0.91 MCL1 (0.37) MCL1ACMSDALDH1A1MAPTCA12
SCHEMBL13298550 0.91 HSD17B1 (0.41) ACMSDGPR84ADORA2AADORA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100133996-A1 Novel anthracene typed compound and the organic electroluminescence display device using the same DONGJIN SEMICHEM CO., LTD (KR) 2010-06-03 — — 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-20100133996-A1 Novel anthracene typed compound and the organic electroluminescence display device using the same TRPA1, TRPM2, TRPM4 MCL1 3996/4885ACMSD 191/4885HDAC4 3769/4885

“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.

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