SCHEMBL1977326

SCHEMBL1977326

CC(C)(C)OC(=O)N1CCC(c2cc(Cl)ccn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.50
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
THRB P10828 1/20 0.50
MEN1 O00255 1/20 0.50
USP2 O75604 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HSD17B10 Q99714 1/20 0.50
STS P08842 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 2/20 0.48
TP53 P04637 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
CNR1 P21554 1/20 0.48
HTT P42858 1/20 0.48
NOS1 P29475 1/20 0.47
NOS2 P35228 1/20 0.47

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
SCHEMBL20743073 0.88 POLB (0.44) GPR119MAPTKDM4EMEN1KMT2A
SCHEMBL16272071 0.86 GPR119 (0.53) GPR119MAPTKDM4ETHRBKMT2A
SCHEMBL28646427 0.86 GPR119 (0.51) GPR119MAPTKDM4ETHRBMEN1
SCHEMBL28812142 0.85 GPR119 (0.50) GPR119MAPTKDM4ETHRBMEN1
SCHEMBL21381792 0.85 HTT (0.51) GPR119MAPTKDM4ETHRBMEN1
SCHEMBL14240401 0.85 GPR119 (0.50) GPR119MAPTKDM4ETHRBMEN1
SCHEMBL28812661 0.83 GPR119 (0.54) GPR119MAPTKDM4ETHRBHTT
SCHEMBL28341565 0.83 GPR119 (0.51) GPR119MAPTKDM4ETHRBMEN1
SCHEMBL29090670 0.83 GPR119 (0.48) GPR119MAPTKDM4ETHRBMEN1
SCHEMBL5472808 0.83 GPR119 (0.48) GPR119MAPTKDM4ETHRBSMN1; SMN2

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-8980903-B2 Fused pyridine, pyrimidine and triazine compounds as cell cycle inhibitors AMGEN INC. (US) 2015-03-17 US disclosed
US-20140350244-A1 FUSED PYRIDINE, PYRIMIDINE AND TRIAZINE COMPOUNDS AS CELL CYCLE INHIBITORS AMGEN INC (US) 2014-11-27 US disclosed
US-8841312-B2 Fused pyridine, pyrimidine and triazine compounds as cell cycle inhibitors AMGEN INC. (US) 2014-09-23 US disclosed
US-20110142796-A1 Fused Pyridine, Pyrimidine and Triazine Compounds as Cell Cycle Inhibitors AMGEN INC (US) 2011-06-16 US 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 (2 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-20140350244-A1 FUSED PYRIDINE, PYRIMIDINE AND TRIAZINE COMPOUNDS AS CELL CYCLE INHIBITORS CDK4, CDKL4, CDK2 GPR119 3465/4885MAPT 2440/4885KDM4E 948/4885
US-20110142796-A1 Fused Pyridine, Pyrimidine and Triazine Compounds as Cell Cycle Inhibitors CDK4, CDKL4, CDK2 GPR119 3465/4885MAPT 2440/4885KDM4E 948/4885

“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.