SCHEMBL16272011

SCHEMBL16272011

CC1C=C(c2ccccn2)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.45
GRM5 P41594 6/20 0.45
GRM1 Q13255 5/20 0.45
USP30 Q70CQ3 1/20 0.43
MMP13 P45452 1/20 0.40
POLB P06746 2/20 0.39
P2RX7 Q99572 1/20 0.38
ABL1 P00519 1/20 0.37
BCR P11274 1/20 0.37

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
SCHEMBL17712408 0.83 SMO (0.42) GRM5POLBP2RX7
SCHEMBL30254699 0.82 UCHL1 (0.39) GRM5GRM1USP30POLB
SCHEMBL30427091 0.78 SMARCA2 (0.39) GPR119GRM5GRM1
SCHEMBL30426870 0.78 SMARCA2 (0.39) GPR119GRM5GRM1
SCHEMBL30426810 0.78 SMARCA2 (0.39) GPR119GRM5GRM1
SCHEMBL31105081 0.78 SMARCA2 (0.39) GPR119GRM5GRM1
SCHEMBL31104864 0.78 SMARCA2 (0.39) GPR119GRM5GRM1
SCHEMBL31105132 0.78 SMARCA2 (0.39) GPR119GRM5GRM1
SCHEMBL16271998 0.78 GPR119 (0.47) GPR119GRM5GRM1
SCHEMBL20111756 0.77 HTR2A (0.46)

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-9732065-B2 Cyclic aminomethyl pyrimidine derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-08-15 US disclosed
US-20160122319-A1 CYCLIC AMINOMETHYL PYRIMIDINE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2016-05-05 US disclosed
EP-3006438-A1 CYCLIC AMINOMETHYL PYRIMIDINE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2016-04-13 EP disclosed
WO-2014192868-A1 CYCLIC AMINOMETHYL PYRIMIDINE DERIVATIVE 大日本住友製薬株式会社 (JP) 2014-12-04 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-20160122319-A1 CYCLIC AMINOMETHYL PYRIMIDINE DERIVATIVE DRD2, DRD4, DRD1 GPR119 702/4885GRM5 202/4885GRM1 22/4885

“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.