SCHEMBL356563

SCHEMBL356563

CCc1cnc(N2CCC(n3cc(F)c4c(Nc5ccc(C(=O)N6CCC(O)C6)cc5Cl)ncnc43)CC2I)nc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 5/20 0.35
KMT2A Q03164 3/20 0.34
WDR5 P61964 2/20 0.34
PDE4B Q07343 1/20 0.34
GRM5 P41594 4/20 0.33
HTR1A P08908 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
PDGFRB P09619 1/20 0.33
KDR P35968 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL358047 0.90 GPR119 (0.40) LRRK2KMT2AWDR5PDE4BGRM5
SCHEMBL358048 0.90 GPR119 (0.40) LRRK2KMT2AWDR5PDE4BGRM5
SCHEMBL355772 0.84 GPR119 (0.44) LRRK2KMT2AWDR5PDE4BPDGFRB
SCHEMBL355773 0.84 GPR119 (0.44) LRRK2KMT2AWDR5PDE4BPDGFRB
SCHEMBL356718 0.84 GPR119 (0.44) LRRK2KMT2AWDR5PDE4BPDGFRB
SCHEMBL10171822 0.83 GPR119 (0.42) LRRK2KMT2AWDR5PDE4BJAK2
SCHEMBL10172690 0.83 GPR119 (0.42) LRRK2KMT2AWDR5PDE4BJAK2
SCHEMBL10172633 0.80 GPR119 (0.43) PDGFRBKDRGPR119CYP3A4CYP2C9
SCHEMBL10172162 0.80 GPR119 (0.43) PDGFRBKDRGPR119CYP3A4CYP2C9
SCHEMBL10171819 0.80 GPR119 (0.45) LRRK2KMT2AWDR5JAK2JAK1

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 1 patent. 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

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 LRRK2 2211/4885KMT2A 2953/4885WDR5 2041/4885

“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.