SCHEMBL6523552

SCHEMBL6523552

CC(C)c1ccc(CN2CC(Oc3ccc(-c4ccc(C(N)=O)c(F)c4)nc3)C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.40
GPR119 Q8TDV5 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MLNR O43193 3/20 0.38
CYP3A4 P08684 1/20 0.38
PARP1 P09874 1/20 0.38
S1PR1 P21453 1/20 0.38
KCNH2 Q12809 1/20 0.37
MCHR1 Q99705 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
PDE9A O76083 1/20 0.37
CHEK2 O96017 1/20 0.36
ACACB O00763 2/20 0.36
PARP15 Q460N3 1/20 0.36
PARP10 Q53GL7 1/20 0.36
MAOB P27338 1/20 0.35

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
SCHEMBL12788257 0.93 GPR119 (0.42) GRM2GPR119MLNRCYP3A4PARP1
SCHEMBL6519362 0.91 GPR119 (0.45) GRM2GPR119MEN1KMT2AMLNR
SCHEMBL3659308 0.89 GPR119 (0.40) GRM2GPR119MEN1KMT2AMLNR
SCHEMBL6525462 0.89 SMN1; SMN2 (0.43) GRM2GPR119MLNRCYP3A4PARP1
SCHEMBL6521815 0.88 GPR119 (0.40) GRM2GPR119MLNRCYP3A4PARP1
SCHEMBL3809270 0.87 MCHR1 (0.42) GRM2GPR119MEN1KMT2AMLNR
SCHEMBL6521804 0.87 CHRM2 (0.44) GRM2GPR119KCNH2
SCHEMBL3662088 0.87 STAT3 (0.41) GPR119PARP1S1PR1
SCHEMBL2896029 0.83 GPR119 (0.38) GRM2GPR119S1PR1PARP15PARP10
SCHEMBL2904085 0.83 GRM2 (0.40) GRM2GPR119PARP15PARP10

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-20110059942-A1 Azetidinyl G-Protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2011-03-10 US disclosed
US-20110059942-A1 Azetidinyl G-Protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2011-03-10 US disclosed
US-20110059942-A1 Azetidinyl G-Protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2011-03-10 US disclosed
WO-2009050522-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-20110059942-A1 Azetidinyl G-Protein Coupled Receptor Agonists GPR119, GIPR, GPR39 GRM2 236/4885GPR119 1/4885MEN1 2395/4885

“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.