SCHEMBL10171822

SCHEMBL10171822

CCc1cnc(N2CCC(n3cc(Cl)c4c(Nc5ccc(C(=O)N6CC[C@H](O)C6)cc5F)ncnc43)CC2)nc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.42
WDR5 P61964 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
LRRK2 Q5S007 3/20 0.36
PDE4B Q07343 1/20 0.35
PDGFRB P09619 1/20 0.35
KDR P35968 1/20 0.35
JAK2 O60674 1/20 0.35
PIK3CA P42336 2/20 0.35
MTOR P42345 2/20 0.35
ERBB2 P04626 1/20 0.35
TYRO3 Q06418 2/20 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
SCHEMBL10172690 1.00 GPR119 (0.42) GPR119WDR5KMT2ACYP3A4CYP2C9
SCHEMBL355773 0.95 GPR119 (0.44) GPR119WDR5KMT2ACYP3A4CYP2C9
SCHEMBL356718 0.95 GPR119 (0.44) GPR119WDR5KMT2ACYP3A4CYP2C9
SCHEMBL355772 0.95 GPR119 (0.44) GPR119WDR5KMT2ACYP3A4CYP2C9
SCHEMBL358047 0.93 GPR119 (0.40) GPR119WDR5KMT2ALRRK2PDE4B
SCHEMBL358048 0.93 GPR119 (0.40) GPR119WDR5KMT2ALRRK2PDE4B
SCHEMBL10172633 0.91 GPR119 (0.43) GPR119CYP3A4CYP2C9PDGFRBKDR
SCHEMBL10172162 0.91 GPR119 (0.43) GPR119CYP3A4CYP2C9PDGFRBKDR
SCHEMBL10171819 0.90 GPR119 (0.45) GPR119WDR5KMT2ACYP3A4CYP2C9
SCHEMBL10172683 0.90 GPR119 (0.45) GPR119KMT2ACYP3A4CYP2C9LRRK2

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 GPR119 1/4885WDR5 2041/4885KMT2A 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.