SCHEMBL4178539

SCHEMBL4178539

CCCC(=O)c1cc(Cl)c(N2CCC(C(=O)NS(=O)(=O)CC3CCCCC3)CC2)nc1CN1CCCC1=O

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 18/20 0.45
GAA P10253 1/20 0.35
MALT1 Q9UDY8 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL4165245 0.99 P2RY12 (0.46) P2RY12GAAMALT1CYP2C9
SCHEMBL3942745 0.95 P2RY12 (0.41) P2RY12
SCHEMBL4171801 0.89 P2RY12 (0.59) P2RY12CYP2C9
SCHEMBL4737138 0.89 P2RY12 (0.50) P2RY12GAAMALT1CYP2C9
SCHEMBL4166711 0.88 P2RY12 (0.59) P2RY12CYP2C9
SCHEMBL4170985 0.87 P2RY12 (0.61) P2RY12CYP2C9
SCHEMBL4168152 0.86 P2RY12 (0.58) P2RY12CYP2C9
SCHEMBL4176210 0.85 P2RY12 (0.54) P2RY12CYP2C9
SCHEMBL4168804 0.85 P2RY12 (0.61) P2RY12CYP2C9
SCHEMBL4171707 0.84 P2RY12 (0.55) P2RY12CYP2C9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090018166-A1 New Pyridine Analogues X 161 ASTRAZENECA AB (SE) 2009-01-15 US claimed
US-20090018166-A1 New Pyridine Analogues X 161 ASTRAZENECA AB (SE) 2009-01-15 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-20090018166-A1 New Pyridine Analogues X 161 P2RY12, P2RY11, P2RY1 P2RY12 1/4885GAA 2890/4885MALT1 3100/4885

“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.