SCHEMBL4237494

SCHEMBL4237494

O=C(O)c1ccccc1C(=O)c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 3/20 0.58
▸ CDC25A P30304 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ ALDH1A1 P00352 3/20 0.53
▸ AKR1C3 P42330 3/20 0.51
▸ ATM Q13315 1/20 0.50
▸ PDK2 Q15119 1/20 0.49
▸ POLB P06746 3/20 0.49
▸ NR4A1 P22736 1/20 0.49
▸ LMNA P02545 1/20 0.46
▸ APEX1 P27695 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ CYP2C8 P10632 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ GAA P10253 1/20 0.44
▸ ALOX15 P16050 1/20 0.42

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
SCHEMBL29307110 0.87 PDK2 (0.48) CDC25BCDC25AHSD17B10ALDH1A1ATM
SCHEMBL29114 0.85 PDK2 (0.58) ATMPDK2
SCHEMBL134286 0.85 PDK2 (0.58) ATMPDK2
SCHEMBL134285 0.85 PDK2 (0.58) ATMPDK2
SCHEMBL2381120 0.85 CDC25B (0.55) CDC25BCDC25AHSD17B10ALDH1A1AKR1C3
SCHEMBL1552743 0.84 PDK2 (0.66) ALDH1A1ATMPDK2LMNACYP2C8
SCHEMBL133477 0.84 PDK2 (0.66) ALDH1A1ATMPDK2LMNACYP2C8
SCHEMBL14124721 0.84 SMN1; SMN2 (0.49) CDC25BCDC25AHSD17B10ALDH1A1AKR1C3
SCHEMBL12337045 0.84 PDK2 (0.60) ALDH1A1ATMPDK2CYP2C8CYP2C9
SCHEMBL5846670 0.84 PDK2 (0.55) PDK2POLBCYP2C8CYP2C9GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014104666-A1 INK COMPOSITION FOR ORGANIC ELECTRONIC ELEMENT, AND ORGANIC ELECTRONIC ELEMENT USING SAME 주식회사 두산 (KR) 2014-07-03 — — WO disclosed
WO-2014104666-A1 INK COMPOSITION FOR ORGANIC ELECTRONIC ELEMENT, AND ORGANIC ELECTRONIC ELEMENT USING SAME 주식회사 두산 (KR) 2014-07-03 — — WO disclosed
US-8395144-B2 Anthracene derivatives and organic electroluminescent device using same DOOSAN CORPORATION (KR) 2013-03-12 — — US disclosed
US-8395144-B2 Anthracene derivatives and organic electroluminescent device using same DOOSAN CORPORATION (KR) 2013-03-12 — — US disclosed
US-8395144-B2 Anthracene derivatives and organic electroluminescent device using same DOOSAN CORPORATION (KR) 2013-03-12 — — US disclosed
US-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME DOOSAN CORPORATION (KR) 2011-03-10 — — US disclosed
US-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME DOOSAN CORPORATION (KR) 2011-03-10 — — US disclosed
US-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME DOOSAN CORPORATION (KR) 2011-03-10 — — US disclosed
WO-2009139580-A2 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2009-11-19 — — WO disclosed
WO-2009139580-A2 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2009-11-19 — — WO 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-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME TRPA1, AHR, ORAI2 CDC25B 2498/4885CDC25A 2826/4885HSD17B10 658/4885

“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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