SCHEMBL2891695

SCHEMBL2891695

NC(=O)c1ccc(-c2ccc(OC3CN(Cc4nnc(C5CC5)s4)C3)cn2)cc1F

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.37
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
PARP10 Q53GL7 2/20 0.36
PARP15 Q460N3 1/20 0.36
GPR119 Q8TDV5 3/20 0.36
RIPK1 Q13546 1/20 0.35
MTOR P42345 1/20 0.35
ROCK2 O75116 1/20 0.34
DGAT1 O75907 1/20 0.33
TGFBR1 P36897 4/20 0.33
MAPK14 Q16539 3/20 0.33
KDR P35968 2/20 0.33
RIPK3 Q9Y572 1/20 0.33
PADI4 Q9UM07 1/20 0.32
PDE2A O00408 1/20 0.32
PDE10A Q9Y233 1/20 0.32
GRM2 Q14416 1/20 0.32

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
SCHEMBL2895545 0.80 MAPK1 (0.40) MAPK1PARP10PARP15GPR119MTOR
SCHEMBL6519362 0.80 GPR119 (0.45) PARP10PARP15GPR119MTORGRM2
SCHEMBL6525462 0.78 SMN1; SMN2 (0.43) PARP10PARP15GPR119GRM2
SCHEMBL3662088 0.78 STAT3 (0.41) GPR119
SCHEMBL6521804 0.78 CHRM2 (0.44) GPR119GRM2
SCHEMBL6523552 0.78 GRM2 (0.40) PARP10PARP15GPR119GRM2
SCHEMBL6521815 0.78 GPR119 (0.40) PARP10PARP15GPR119GRM2
SCHEMBL12788257 0.76 GPR119 (0.42) PARP10PARP15GPR119GRM2
SCHEMBL13024338 0.75 MAPK1 (0.36) MAPK1PARP10PARP15GPR119MTOR
SCHEMBL2896254 0.75 GPR119 (0.39) MAPK1PARP10PARP15GPR119MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100286110-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
US-20100286110-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
US-20100286110-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
WO-2009050523-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2009-04-23 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-20100286110-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS GPR119, GIPR, GPR39 MAPK1 1491/4885GRIN1 465/4885GRIN2B 504/4885

“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.