SCHEMBL13858494

SCHEMBL13858494

CCCCN1C(=O)c2cc(-c3ccc(-c4ccc(-c5cc6c(s5)C(=O)N(CCCC)C6=O)s4)s3)sc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ USP2 O75604 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ RGS12 O14924 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ TLR9 Q9NR96 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ ALDH1A1 P00352 5/20 0.37
▸ ALDH2 P05091 1/20 0.36
▸ ALDH3A1 P30838 1/20 0.36
▸ TERT O14746 2/20 0.36
▸ CES1 P23141 2/20 0.35
▸ CDC25A P30304 1/20 0.35
▸ CA12 O43570 1/20 0.35

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
SCHEMBL17014620 0.93 HSF1 (0.39) MAPK1MEN1USP2KMT2AL3MBTL1
SCHEMBL15720645 0.92 TNFRSF1A (0.35) MAPK1MEN1USP2KMT2AL3MBTL1
SCHEMBL13978139 0.91 TNFRSF1A (0.36) MAPK1MEN1USP2KMT2AL3MBTL1
SCHEMBL15720278 0.90 DPP4 (0.39) MAPK1MEN1USP2KMT2AL3MBTL1
SCHEMBL15739393 0.90 MAPK1 (0.33) MAPK1MEN1USP2KMT2AL3MBTL1
SCHEMBL15739370 0.89 CDC25A (0.34) L3MBTL1TDP1ALDH1A1ALDH2ALDH3A1
SCHEMBL15739857 0.88 MEN1 (0.33) MAPK1MEN1USP2KMT2AL3MBTL1
SCHEMBL17014621 0.88 CDC25A (0.39) ALDH1A1ALDH2ALDH3A1CES1CDC25A
SCHEMBL15739410 0.87 CDC25A (0.38) ALDH1A1ALDH2ALDH3A1CES1CDC25A
SCHEMBL17148357 0.87 CDC25A (0.38) ALDH1A1ALDH2ALDH3A1CES1CDC25A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9761810-B2 Organic semiconductor material E.T.C. S.R.L. (IT) 2017-09-12 — — US disclosed
US-9761810-B2 Organic semiconductor material E.T.C. S.R.L. (IT) 2017-09-12 — — US disclosed
US-9761810-B2 Organic semiconductor material E.T.C. S.R.L. (IT) 2017-09-12 — — US disclosed
US-20150311448-A1 ORGANIC SEMICONDUCTOR MATERIAL USINVEST LLC 2015-10-29 — — US disclosed
US-20150311448-A1 ORGANIC SEMICONDUCTOR MATERIAL USINVEST LLC 2015-10-29 — — US disclosed
US-20150311448-A1 ORGANIC SEMICONDUCTOR MATERIAL USINVEST LLC 2015-10-29 — — US disclosed
EP-2710012-B1 ORGANIC SEMICONDUCTOR MATERIAL E T C SRL (IT) 2015-06-24 — — EP disclosed
EP-2710012-B1 ORGANIC SEMICONDUCTOR MATERIAL E T C SRL (IT) 2015-06-24 — — EP disclosed
US-20140217374-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2014-08-07 — — US disclosed
US-20140217374-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2014-08-07 — — US disclosed
US-20140217374-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2014-08-07 — — US disclosed
EP-2710012-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.r.l. (IT) 2014-03-26 — — EP disclosed
WO-2012156948-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2012-11-22 — — WO disclosed
WO-2012156948-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2012-11-22 — — 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-20150311448-A1 ORGANIC SEMICONDUCTOR MATERIAL OR10J3, TST, OR51E2 MAPK1 4510/4885MEN1 1509/4885USP2 3826/4885

“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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