SCHEMBL1713003

SCHEMBL1713003

Cc1csc(N2CC[CH]CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 1/20 0.44
OGA O60502 2/20 0.43
MEN1 O00255 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
DPP4 P27487 1/20 0.41
POLB P06746 2/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
AR P10275 4/20 0.39
NOS1 P29475 1/20 0.38
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
EP300 Q09472 1/20 0.36
KAT2A Q92830 1/20 0.36

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
SCHEMBL3511935 0.84 L3MBTL1 (0.54) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL4472290 0.84 L3MBTL1 (0.54) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL4469579 0.82 SMN1; SMN2 (0.53) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL6929063 0.81 ALDH1A1 (0.54) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL9794819 0.81 L3MBTL1 (0.47) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL3550824 0.80 L3MBTL1 (0.47) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL2228747 0.79 BAZ2A (0.49) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL4463690 0.79 LMNA (0.68) SMN1; SMN2LMNAMEN1MAPTMAPK1
SCHEMBL23155993 0.78 L3MBTL1 (0.57) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL10136842 0.78 HRH3 (0.49) L3MBTL1SMN1; SMN2LMNAOGAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263605-B2 Modulators of muscarinic receptors VERTEX PHARMACEUTICAL INCORPORATED (US) 2012-09-11 US claimed
US-20090227614-A1 Modulators of Muscarinic Receptors VERTEX PHARMACEUTICALS INCORPORATED 2009-09-10 US claimed
EP-1987034-A1 SPIRO CONDENSED PIPERIDNES AS MODULATORS OF MUSCARINIC RECEPTORS Vertex Pharmceuticals Incorporated (US) 2008-11-05 EP claimed
WO-2007100670-A1 SPIRO CONDENSED PIPERIDNES AS MODULATORS OF MUSCARINIC RECEPTORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-09-07 WO claimed
US-8263605-B2 Modulators of muscarinic receptors VERTEX PHARMACEUTICAL INCORPORATED (US) 2012-09-11 US disclosed
EP-1987034-B1 SPIRO CONDENSED PIPERIDINES AS MODULATORS OF MUSCARINIC RECEPTORS VERTEX PHARMA (US) 2011-07-20 EP disclosed
US-20090227614-A1 Modulators of Muscarinic Receptors VERTEX PHARMACEUTICALS INCORPORATED 2009-09-10 US disclosed
EP-1987034-A1 SPIRO CONDENSED PIPERIDNES AS MODULATORS OF MUSCARINIC RECEPTORS Vertex Pharmceuticals Incorporated (US) 2008-11-05 EP disclosed
WO-2007100670-A1 SPIRO CONDENSED PIPERIDNES AS MODULATORS OF MUSCARINIC RECEPTORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-09-07 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-20090227614-A1 Modulators of Muscarinic Receptors CHRM5, CHRM3, CHRM2 L3MBTL1 3891/4885SMN1; SMN2 1813/4885LMNA 3546/4885

“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.