SCHEMBL1769372

SCHEMBL1769372

COC1CCC(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)N1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.36
GPR119 Q8TDV5 3/20 0.36
STS P08842 1/20 0.36
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35
GAA P10253 1/20 0.35
THRB P10828 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
SMYD2 Q9NRG4 2/20 0.34
CETP P11597 2/20 0.34
LMNA P02545 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL15348386 0.94 GPR119 (0.37) ABCB1GPR119STSKDM4EPKM
SCHEMBL15348384 0.94 GPR119 (0.37) ABCB1GPR119STSKDM4EPKM
SCHEMBL13759689 0.87 ABCB1 (0.40) ABCB1GPR119STSKDM4EPKM
SCHEMBL29007758 0.87 ABCB1 (0.38) ABCB1GPR119STSKDM4EPKM
SCHEMBL1769258 0.87 ABCB1 (0.38) ABCB1GPR119STSKDM4EPKM
SCHEMBL17948125 0.87 ABCB1 (0.38) ABCB1GPR119STSKDM4EPKM
SCHEMBL31224155 0.87 ABCB1 (0.40) ABCB1GPR119STSKDM4EPKM
SCHEMBL31224004 0.86 ABCB1 (0.37) ABCB1GPR119STSKDM4EPKM
SCHEMBL29282039 0.85 ABCB1 (0.38) ABCB1GPR119STSKDM4EPKM
SCHEMBL13759697 0.83 ABCB1 (0.35) ABCB1GPR119STSKDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513085-B1 BICYCLIC COMPOUNDS AS ALPHA4BETA2 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2016-09-28 EP disclosed
EP-2519514-B1 ALPHA4BETA2 NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2015-08-26 EP disclosed
US-8735423-B2 Bicyclic compounds as α4β2 nicotinic acetylcholine receptor ligands SUVEN LIFE SCIENCES LIMITED (IN) 2014-05-27 US disclosed
US-8653071-B2 α4β2 neuronal nicotinic acetylcholine receptor ligands SUVEN LIFE SCIENCES LIMITED (IN) 2014-02-18 US disclosed
US-20130072518-A1 BICYCLIC COMPOUNDS AS alpha4 beta2 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS Suven Life Science Limited (IN) 2013-03-21 US disclosed
US-20120322808-A1 Alpha 4 Beta 2 NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2012-12-20 US disclosed
EP-2519514-A2 ALPHA4BETA2 NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS Suven Life Sciences Limited (IN) 2012-11-07 EP disclosed
EP-2513085-A1 BICYCLIC COMPOUNDS AS alpha4beta2 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS Suven Life Sciences Limited (IN) 2012-10-24 EP disclosed
WO-2011080751-A2 α4β2 NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2011-07-07 WO disclosed
WO-2011061751-A1 BICYCLIC COMPOUNDS AS α4β2 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2011-05-26 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 (2 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-20130072518-A1 BICYCLIC COMPOUNDS AS alpha4 beta2 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA4, CHRNB4, CHRNA2 ABCB1 819/4885GPR119 239/4885STS 3837/4885
US-20120322808-A1 Alpha 4 Beta 2 NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNB2, CHRNB4, CHRNA4 ABCB1 2033/4885GPR119 112/4885STS 4550/4885

“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.