SCHEMBL388434

SCHEMBL388434

c1cnc(N2CCC(CCCCc3ccncc3)CC2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.47
DRD3 P35462 2/20 0.47
HTR1A P08908 1/20 0.47
DRD1 P21728 1/20 0.47
DRD5 P21918 1/20 0.47
HTR2A P28223 1/20 0.47
KDM4E B2RXH2 4/20 0.43
NMT1 P30419 2/20 0.40
CYP2C19 P33261 1/20 0.40
CHRM4 P08173 1/20 0.40
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
CYP3A4 P08684 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
GRIN2B Q13224 1/20 0.39
ADRA1D P25100 2/20 0.39
ADRA1A P35348 2/20 0.39
ADRA1B P35368 2/20 0.39
SLC18A3 Q16572 1/20 0.39
HRH1 P35367 2/20 0.38

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
SCHEMBL391220 0.85 POLB (0.52) DRD2DRD3HTR1ADRD1DRD5
SCHEMBL1575090 0.81 GPR119 (0.58) DRD2DRD3HTR1ADRD1DRD5
SCHEMBL9633099 0.77 HTR1A (0.75) DRD2DRD3HTR1ADRD1DRD5
SCHEMBL28170205 0.76 KDM4E (0.50) DRD2DRD3KDM4ECYP2C19CHRM4
SCHEMBL3867303 0.75 KDM4E (0.44) KDM4EGRIN2BSLC18A3
SCHEMBL17064317 0.75 HRH1 (0.48) CYP3A4SLC18A3HRH1
SCHEMBL3681167 0.73 HRH3 (0.49) NMT1HRH1
SCHEMBL5046282 0.73 S1PR1 (0.44) SIGMAR1SLC18A3
SCHEMBL4418417 0.72 KDM4E (0.49) DRD2DRD3KDM4ECYP2C19CHRM4
SCHEMBL389808 0.70 CYP2C9 (0.54) CYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101123964-B G-protein coupled receptor (GPR116) agonists and pharmaceutical compositions comprising the same PROSIDION LTD 2012-11-28 CN disclosed
US-8101626-B2 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
EP-2004157-B1 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AS WELL AS COMBINATION THERAPY RELATING THERETO ARENA PHARM INC (US) 2011-01-12 EP disclosed
EP-2253311-A2 Use of GPR119 receptor agonists for increasing bone mass and for treating osteoporosis, as well as combination therapy relating thereto Arena Pharmaceuticals, Inc. (US) 2010-11-24 EP disclosed
US-7816364-B2 GRP119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. (US) 2010-10-19 US disclosed
US-20100190750-A1 GPR119 Receptor Agonists in Methods of Increasing Bone Mass and of Treating Osteoporosis and Other Conditions Characterized by Low Bone Mass, and Combination Therapy Relating Thereto ARENA PHARMACEUTICALS, INC. (US) 2010-07-29 US disclosed
US-20090270422-A1 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. 2009-10-29 US disclosed
EP-2004157-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AS WELL AS COMBINATION THERAPY RELATING THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-24 EP disclosed
US-20080312281-A1 G-Protein Coupled Receptor (Gpr116) Agonists and Use Thereof for Treating Obesity and Diabetes PROSIDION LIMITED (GB) 2008-12-18 US disclosed
US-20080312281-A1 G-Protein Coupled Receptor (Gpr116) Agonists and Use Thereof for Treating Obesity and Diabetes PROSIDION LIMITED (GB) 2008-12-18 US disclosed
US-20080312281-A1 G-Protein Coupled Receptor (Gpr116) Agonists and Use Thereof for Treating Obesity and Diabetes PROSIDION LIMITED (GB) 2008-12-18 US disclosed
CN-101123964-A G-protein coupled receptor (GPR116) agonists and their use for the treatment of obesity and diabetes PROSIDION LTD (GB) 2008-02-13 CN disclosed
WO-2007120702-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AND COMBINATION THERAPY RELATING THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO disclosed
EP-1838311-A1 G-PROTEIN COUPLED RECEPTOR (GPR116) AGONISTS AND USE THEREOF FOR TREATING OBESITY AND DIABETES Prosidion Limited (GB) 2007-10-03 EP disclosed
WO-2006067531-A1 G-PROTEIN COUPLED RECEPTOR (GPR116) AGONISTS AND USE THEREOF FOR TREATING OBESITY AND DIABETES PROSIDION LTD (GB) 2006-06-29 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 (3 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-20100190750-A1 GPR119 Receptor Agonists in Methods of Increasing Bone Mass and of Treating Osteoporosis and Other Conditions Characterized by Low Bone Mass, and Combination Therapy Relating Thereto GPR119, GLP1R, GPR4 DRD2 1312/4885DRD3 1772/4885HTR1A 343/4885
US-20080312281-A1 G-Protein Coupled Receptor (Gpr116) Agonists and Use Thereof for Treating Obesity and Diabetes GPR119, GCGR, GPR65 DRD2 1845/4885DRD3 2539/4885HTR1A 333/4885
US-20090270422-A1 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto GPR119, GLP1R, GPR4 DRD2 1312/4885DRD3 1772/4885HTR1A 343/4885

“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.