SCHEMBL357484

SCHEMBL357484

CCOC(=O)c1cn(C2CCN(C(=O)OC(C)(C)C)CC2)c2ncnc(Cl)c12

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
SRC P12931 8/20 0.47
EGFR P00533 3/20 0.47
TP53 P04637 2/20 0.46
POLB P06746 1/20 0.46
ABL1 P00519 2/20 0.44
ABL2 P42684 2/20 0.44
HPGD P15428 2/20 0.43
GPR119 Q8TDV5 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NR3C1 P04150 2/20 0.41
ADK P55263 1/20 0.41
CYP3A4 P08684 1/20 0.40

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
SCHEMBL19731361 0.85 SRC (0.52) SRCEGFRTP53ABL1ABL2
SCHEMBL357171 0.84 SRC (0.52) SRCEGFRPOLBABL1ABL2
SCHEMBL10139717 0.84 SRC (0.53) SRCEGFRPOLBABL1ABL2
SCHEMBL10140510 0.83 ADK (0.47) ALDH1A1KMT2ALMNASRCEGFR
SCHEMBL355753 0.82 SRC (0.52) MEN1SRCEGFRABL1ABL2
SCHEMBL29503465 0.82 SRC (0.52) SRCEGFRPOLBABL1ABL2
SCHEMBL6866966 0.82 SRC (0.52) SRCEGFRPOLBABL1ABL2
SCHEMBL19731353 0.80 SRC (0.60) SRCEGFRABL1ABL2NR3C1
SCHEMBL10139976 0.78 GPR119 (0.44) SRCEGFRTP53POLBABL1
SCHEMBL21880090 0.77 ALDH1A1 (0.48) ALDH1A1MEN1KMT2ALMNAGAA

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-20120016119-A1 NOVEL PYRROLO(2,3-d)PYRIMIDINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-01-19 US disclosed
US-20120016119-A1 NOVEL PYRROLO(2,3-d)PYRIMIDINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-01-19 US disclosed
EP-2390254-A1 NOVEL PYRROLOÝ2,3-d¨PYRIMIDINE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2011-11-30 EP disclosed
US-20110257678-A1 VASCULAR EMBOLIC FILTER EXCHANGE DEVICES AND METHODS OF USE THEREOF INCEPT LLC (US) 2011-10-20 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 (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-20120016119-A1 NOVEL PYRROLO(2,3-d)PYRIMIDINE COMPOUND GPR119, GPR139, HCAR1 ALDH1A1 1676/4885MEN1 4883/4885KMT2A 2953/4885

“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.