SCHEMBL17014622

SCHEMBL17014622

CCCCCc1ccc(-c2cc3sc(-c4cc5c(s4)C(=O)N(CCCC)C5=O)cc3s2)s1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.33
▸ MGLL Q99685 1/20 0.33
▸ ALDH1A1 P00352 5/20 0.32
▸ ALDH2 P05091 1/20 0.32
▸ ALDH3A1 P30838 1/20 0.32
▸ L3MBTL1 Q9Y468 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ USP2 O75604 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ TDP1 Q9NUW8 2/20 0.31
▸ RGS12 O14924 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ TLR9 Q9NR96 1/20 0.31
▸ CES1 P23141 2/20 0.31
▸ CDC25A P30304 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 0.93 CDC25A (0.34) FAAHMGLLALDH1A1ALDH2ALDH3A1
SCHEMBL13858494 0.84 MAPK1 (0.38) ALDH1A1ALDH2ALDH3A1L3MBTL1MEN1
SCHEMBL15739399 0.82 CDC25A (0.33) FAAHMGLLALDH1A1ALDH2ALDH3A1
SCHEMBL15739466 0.81 MAPK1 (0.33) ALDH1A1L3MBTL1MEN1USP2MAPK1
SCHEMBL17014620 0.79 HSF1 (0.39) ALDH1A1ALDH2ALDH3A1L3MBTL1MEN1
SCHEMBL13978139 0.79 TNFRSF1A (0.36) ALDH1A1ALDH2ALDH3A1L3MBTL1MEN1
SCHEMBL15720645 0.78 TNFRSF1A (0.35) ALDH1A1ALDH2ALDH3A1L3MBTL1MEN1
SCHEMBL13859037 0.78 FAAH (0.36) FAAHMGLLALDH1A1TDP1POLB
SCHEMBL15720775 0.77 CDC25A (0.39) FAAHMGLLALDH1A1ALDH2ALDH3A1
SCHEMBL17014621 0.77 CDC25A (0.39) FAAHMGLLALDH1A1ALDH2ALDH3A1

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 5 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

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 FAAH 4787/4885MGLL 3709/4885ALDH1A1 3257/4885

“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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