SCHEMBL1363777

SCHEMBL1363777

CC(C)(C)N(Cc1cc(F)cc(-c2cccc(CO[Si](C)(C)C(C)(C)C)c2)c1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
FFAR1 O14842 1/20 0.36
HTT P42858 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 7/20 0.35
ALDH1A1 P00352 4/20 0.35
SCD5 Q86SK9 1/20 0.35
AGXT P21549 1/20 0.35
ENPP2 Q13822 1/20 0.35
TSHR P16473 4/20 0.35
NPSR1 Q6W5P4 4/20 0.35
KDM4E B2RXH2 1/20 0.35
TACR1 P25103 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL1363398 0.89 MEN1 (0.39) MEN1KMT2AFFAR1HTTL3MBTL1
SCHEMBL1363225 0.87 TSHR (0.46) MEN1KMT2AFFAR1HTTL3MBTL1
SCHEMBL1362409 0.82 LMNA (0.41) MEN1KMT2AFFAR1HTTL3MBTL1
SCHEMBL1362264 0.82 FFAR1 (0.34) MEN1KMT2AFFAR1HTTL3MBTL1
SCHEMBL4095280 0.81 TACR1 (0.44) GRM2FFAR1ENPP2TACR1DHODH
SCHEMBL1362144 0.79 CD274 (0.41) MEN1KMT2AFFAR1LMNA
SCHEMBL1362748 0.78 TRIM24 (0.41) MEN1KMT2AHTTL3MBTL1LMNA
SCHEMBL1364563 0.77 LMNA (0.38) MEN1KMT2AFFAR1HTTLMNA
SCHEMBL12053374 0.77 TACR1 (0.41) GRM2LMNAENPP2TSHRTACR1
SCHEMBL3404871 0.75 CTSA (0.37) GRM2FFAR1AGXTENPP2TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8071588-B2 Dual pharmacophores—PDE4-muscarinic antagonistics GLAXO GROUP LIMITED (GB) 2011-12-06 US disclosed
US-8067408-B2 Dual pharmacophores—PDE4-muscarinic antagonistics GLAXO GROUP LIMITED (GB) 2011-11-29 US disclosed
US-20090203677-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics GLAXO GROUP LIMITED (GB) 2009-08-13 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-20090203677-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics PDE4A, PDE4B, PDE1A GRM2 716/4885MEN1 4113/4885KMT2A 2211/4885

“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.