SCHEMBL15739399

SCHEMBL15739399

C=CCCCc1ccc(-c2ccc(-c3ccc(-c4cc5c(s4)C(=O)N(CCCCCC)C5=O)s3)s2)s1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 11/20 0.33
▸ CES1 P23141 2/20 0.33
▸ ALOX15 P16050 1/20 0.32
▸ MGLL Q99685 3/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ ALDH2 P05091 1/20 0.31
▸ ALDH3A1 P30838 1/20 0.31
▸ PTGS1 P23219 2/20 0.31
▸ PTGS2 P35354 2/20 0.31
▸ FAAH O00519 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
SCHEMBL15739370 0.88 CDC25A (0.34) CDC25ACES1MGLLALDH1A1ALDH2
SCHEMBL17014622 0.82 FAAH (0.33) CDC25ACES1ALOX15MGLLALDH1A1
SCHEMBL17148357 0.81 CDC25A (0.38) CDC25ACES1MGLLALDH1A1ALDH2
SCHEMBL13858494 0.80 MAPK1 (0.38) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL15739853 0.80 CDC25A (0.39) CDC25ACES1MGLLALDH1A1ALDH2
SCHEMBL17014621 0.80 CDC25A (0.39) CDC25ACES1MGLLALDH1A1ALDH2
SCHEMBL15739410 0.79 CDC25A (0.38) CDC25ACES1MGLLALDH1A1ALDH2
SCHEMBL15720775 0.77 CDC25A (0.39) CDC25ACES1MGLLALDH1A1ALDH2
SCHEMBL15739466 0.77 MAPK1 (0.33) ALDH1A1
SCHEMBL17148358 0.76 CDC25A (0.38) CDC25ACES1MGLLALDH1A1ALDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9502665-B2 Organic semiconductor material E.T.C. S.R.L. (IT) 2016-11-22 — — US disclosed
US-9502665-B2 Organic semiconductor material E.T.C. S.R.L. (IT) 2016-11-22 — — US disclosed
EP-2920184-B1 ORGANIC SEMICONDUCTOR MATERIAL E T C SRL (IT) 2016-09-14 — — EP disclosed
US-20150236270-A1 ORGANIC SEMICONDUCTOR MATERIAL USINVEST LLC 2015-08-20 — — US disclosed
US-20150236270-A1 ORGANIC SEMICONDUCTOR MATERIAL USINVEST LLC 2015-08-20 — — US disclosed
WO-2014076650-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2014-05-22 — — 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-20150236270-A1 ORGANIC SEMICONDUCTOR MATERIAL OR10J3, TST, AS3MT CDC25A 1100/4885CES1 4514/4885ALOX15 4089/4885

“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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