SCHEMBL4546758

SCHEMBL4546758

Cn1cc[n+](CCCCC[n+]2ccn(Cc3ccccc3)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EEF2K O00418 2/20 0.35
▸ EEF2 P13639 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ PLK4 O00444 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ TYK2 P29597 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ ITK Q08881 1/20 0.35
▸ PIM2 Q9P1W9 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP19A1 P11511 1/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34

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
SCHEMBL11999065 0.91 CYP1A2 (0.40) MEN1KMT2ACYP1A2POLBCYP3A4
SCHEMBL5817318 0.87 ABCB11 (0.46) —
SCHEMBL5295972 0.87 ABCB11 (0.46) —
SCHEMBL5297847 0.87 ABCB11 (0.46) —
SCHEMBL5298450 0.87 ABCB11 (0.46) —
SCHEMBL5301214 0.87 ABCB11 (0.46) —
SCHEMBL5295433 0.87 ABCB11 (0.46) —
SCHEMBL5304009 0.87 ABCB11 (0.46) —
SCHEMBL5813633 0.87 ABCB11 (0.46) —
SCHEMBL5307703 0.87 ABCB11 (0.46) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8956445-B2 High stability diionic liquid salts SIGMA-ALDRICH CO. (US) 2015-02-17 — — US disclosed
US-8956445-B2 High stability diionic liquid salts SIGMA-ALDRICH CO. (US) 2015-02-17 — — US disclosed
US-20120211696-A1 HIGH STABILITY DIIONIC LIQUID SALTS SIGMA-ALDRICH CO. LLC (US) 2012-08-23 — — US disclosed
US-8168830-B2 use of these novel ionic liquids having bis-cation or bis-anion separated by bridging group as the stationary phase in a gas chromatographic column SIGMA-ALDRICH CO. LLC (US) 2012-05-01 — — US disclosed
US-8168830-B2 use of these novel ionic liquids having bis-cation or bis-anion separated by bridging group as the stationary phase in a gas chromatographic column SIGMA-ALDRICH CO. LLC (US) 2012-05-01 — — US disclosed
US-20080027231-A1 High stability diionic liquid salts SIGMA-ALDRICH CO. (US) 2008-01-31 — — US disclosed
US-20080027231-A1 High stability diionic liquid salts SIGMA-ALDRICH CO. (US) 2008-01-31 — — 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-20080027231-A1 High stability diionic liquid salts H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HDHD5, DAD1 EEF2K 4303/4885EEF2 3892/4885MEN1 3166/4885

“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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