SCHEMBL1402879

SCHEMBL1402879

CN(C)c1ccc(C=Cc2cc[n+](C)cc2)cc1.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.58
▸ KMT2A Q03164 6/20 0.58
▸ MAPT P10636 4/20 0.58
▸ ALDH1A1 P00352 4/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ GFER P55789 2/20 0.58
▸ LMNA P02545 2/20 0.58
▸ HTT P42858 2/20 0.58
▸ ALPG P10696 1/20 0.58
▸ THRB P10828 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ GAA P10253 2/20 0.48
▸ CASP1 P29466 1/20 0.48
▸ BRCA1 P38398 1/20 0.48
▸ CASP7 P55210 1/20 0.48
▸ HBB P68871 1/20 0.48
▸ RAB9A P51151 4/20 0.47
▸ NPC1 O15118 3/20 0.47
▸ APOBEC3A P31941 2/20 0.47
▸ APOBEC3G Q9HC16 2/20 0.47

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
SCHEMBL531127 0.83 MEN1 (0.63) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL531126 0.83 MEN1 (0.63) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL2160671 0.80 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL17158654 0.80 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL8991523 0.79 MEN1 (0.69) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL9140957 0.79 MEN1 (0.69) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL1898081 0.78 MEN1 (0.96) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL1898080 0.78 MEN1 (0.96) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL5402822 0.77 MEN1 (0.61) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
Iodide SCHEMBL531166 0.76 MEN1 (1.00) MEN1KMT2AMAPTALDH1A1SMN1; SMN2

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
EP-2291712-B1 PHENOLIC CONFIGURATIONALLY LOCKED POLYENE BULK SINGLE CRYSTALS, CRYSTALLINE THIN FILMS AND WAVEGUIDES FOR ELECTRO-OPTICS AND THZ-WAVE APPLICATIONS RAINBOW PHOTONICS AG (CH) 2021-06-02 — — EP disclosed
US-8846969-B2 Phenolic configurationally locked polyene bulk single crystals, crystalline thin films and waveguides for electro-optics and THz-wave applications RAINBOW PHOTONICS AG (CH) 2014-09-30 — — US disclosed
US-20110128610-A1 PHENOLIC CONFIGURATIONALLY LOCKED POLYENE BULK SINGLE CRYSTALS, CRYSTALLINE THIN FILMS AND WAVEGUIDES FOR ELECTRO-OPTICS AND THZ-WAVE APPLICATIONS RAINBOW PHOTONICS AG (CH) 2011-06-02 — — US disclosed
EP-2291712-A1 PHENOLIC CONFIGURATIONALLY LOCKED POLYENE BULK SINGLE CRYSTALS, CRYSTALLINE THIN FILMS AND WAVEGUIDES FOR ELECTRO-OPTICS AND THZ-WAVE APPLICATIONS Eidgenössische Technische Hochschule Zürich (CH) 2011-03-09 — — EP disclosed
WO-2009135329-A1 PHENOLIC CONFIGURATIONALLY LOCKED POLYENE BULK SINGLE CRYSTALS, CRYSTALLINE THIN FILMS AND WAVEGUIDES FOR ELECTRO-OPTICS AND THZ-WAVE APPLICATIONS Eidgenössische Technische Hochschule Zürich (CH) 2009-11-12 — — 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-20110128610-A1 PHENOLIC CONFIGURATIONALLY LOCKED POLYENE BULK SINGLE CRYSTALS, CRYSTALLINE THIN FILMS AND WAVEGUIDES FOR ELECTRO-OPTICS AND THZ-WAVE APPLICATIONS MYB, TCF12, PCBP1 MEN1 3605/4885KMT2A 2264/4885MAPT 181/4885

“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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