SCHEMBL11892871

SCHEMBL11892871

CCc1cc2c(s1)-c1sc(CC)cc1C2=C(C#N)C#N

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ PKM P14618 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 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
SCHEMBL15281521 0.92 — —
SCHEMBL12188685 0.88 LMNA (0.31) —
SCHEMBL15278452 0.78 — —
SCHEMBL12951124 0.76 ALDH1A1 (0.35) MAPTALDH1A1PKMGAA
SCHEMBL12567044 0.71 ALDH1A1 (0.33) MAPTALDH1A1PKMGAA
SCHEMBL18874431 0.71 ALDH1A1 (0.33) MAPTALDH1A1PKMGAA
SCHEMBL11892888 0.69 TMIGD3 (0.37) MAPTALDH1A1GAAL3MBTL1MEN1
SCHEMBL31299604 0.68 MAPK14 (0.32) —
SCHEMBL12314779 0.68 SELE (0.33) MAPTALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL11892900 0.67 SELE (0.33) MAPTALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016029843-A1 NAPHTHALENE DIIMIDE CONTAINING 2-(1,3-DITHIO/SELENO-2-SUBUNIT)ETHYLCYANIDE CONJUGATE STRUCTURAL UNIT AND DERIVATIVES THEREOF 中国科学院上海有机化学研究所 2016-03-03 — — WO disclosed
US-8334456-B2 Conjugated polymers and their use in optoelectronic devices POLYERA CORPORATION (US) 2012-12-18 — — US disclosed
US-8329855-B2 Thienocoronene-imide semiconducting compounds and polymers POLYERA CORPORATION (US) 2012-12-11 — — US disclosed
US-20120264900-A1 THIENOCORONENE-IMIDE SEMICONDUCTING COMPOUNDS AND POLYMERS USINVEST LLC 2012-10-18 — — US disclosed
US-20120217482-A1 SEMICONDUCTOR MATERIALS PREPARED FROM DITHIENYLVINYLENE COPOLYMERS POLYERA CORPORATION (US) 2012-08-30 — — US disclosed
US-20120187385-A1 Conjugated Polymers and Their Use in Optoelectronic Devices RAYNERGY TEK INC. (TW) 2012-07-26 — — US disclosed
US-20110232764-A1 Conjugated Polymers and Devices Incorporating Same FLEXTERRA, INC. 2011-09-29 — — US disclosed
US-20110226338-A1 PYRROLO[3,2-B]PYRROLE SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME RAYNERGY TEK INC. (TW) 2011-09-22 — — US disclosed
US-20110120558-A1 SEMICONDUCTOR MATERIALS PREPARED FROM RYLENE-(PI-ACCEPTOR)COPOLYMERS BASF SE 2011-05-26 — — US disclosed
US-20100326527-A1 NAPHTALENE-IMIDE SEMICONDUCTOR POLYMERS BASF SE 2010-12-30 — — US disclosed
US-20100307594-A1 Conjugated Polymers and Their Use in Optoelectronic Devices RAYNERGY TEK INC. (TW) 2010-12-09 — — US disclosed
US-20100283047-A1 PERYLENE-IMIDE SEMICONDUCTOR POLYMERS BASF SE (DE) 2010-11-11 — — 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-20120264900-A1 THIENOCORONENE-IMIDE SEMICONDUCTING COMPOUNDS AND POLYMERS TST, TPR, SLC19A2 MAPT 1782/4885ALDH1A1 4190/4885PKM 3235/4885

“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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