SCHEMBL14970397

SCHEMBL14970397

CC(=O)N1CCc2scnc2C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.51
GRM5 P41594 4/20 0.44
DRD2 P14416 5/20 0.44
DRD3 P35462 5/20 0.44
NOTUM Q6P988 1/20 0.42
BPTF Q12830 1/20 0.37
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 2/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ENPP2 Q13822 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 3/20 0.35
LMNA P02545 1/20 0.35
BAZ2B Q9UIF8 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CREBBP Q92793 1/20 0.34
OGA O60502 1/20 0.34
TP53 P04637 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
SCHEMBL25389751 0.80 ESR2 (0.46) MAPK1GRM5KDM4EMAPT
SCHEMBL550104 0.73 DRD2 (0.50) MAPK1GRM5DRD2DRD3ALDH1A1
SCHEMBL7258756 0.73 NOTUM (0.47) MAPK1GRM5NOTUMBPTFALDH1A1
SCHEMBL6436553 0.72 MAPK1 (0.49) MAPK1GRM5DRD2DRD3KDM4E
SCHEMBL4052245 0.71 MAPK1 (0.67) MAPK1GRM5DRD2DRD3
SCHEMBL24576865 0.71 DRD2 (0.51) MAPK1GRM5DRD2DRD3KDM4E
SCHEMBL8680487 0.70 NOTUM (0.57) DRD2DRD3NOTUM
SCHEMBL741667 0.69 MAPK1 (0.59) MAPK1GRM5DRD2DRD3ALDH1A1
SCHEMBL4990995 0.69 MAP4K4 (0.41) NOTUMBPTFMAPTLMNABAZ2B
SCHEMBL30916184 0.68 MAPK1 (0.58) MAPK1GRM5KDM4EMAPT

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
EP-2780337-B1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME (US) 2017-12-20 EP disclosed
US-9018224-B2 Substituted cyclopropyl compounds useful as GPR119 agonists MERCK SHARP & DOHME CORP. (US) 2015-04-28 US disclosed
US-20140329798-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME LLC 2014-11-06 US disclosed
WO-2013074388-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME CORP. (US) 2013-05-23 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-20140329798-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS GPR119, GPR27, GCGR MAPK1 2413/4885GRM5 313/4885DRD2 1050/4885

“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.