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SCHEMBL2459259

SCHEMBL2459259

Cc1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 15/20 0.51
▸ ALKBH3 Q96Q83 2/20 0.50
▸ CCR5 P51681 4/20 0.46
▸ ADCY10 Q96PN6 1/20 0.45
▸ PNP P00491 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
SCHEMBL2463316 0.89 THRB (0.46) CCR2ALKBH3
SCHEMBL2465055 0.87 CCR2 (0.50) CCR2ALKBH3CCR5ADCY10PNP
SCHEMBL2456787 0.87 CCR2 (0.43) CCR2ALKBH3
SCHEMBL2454543 0.87 ADCY10 (0.44) CCR2ALKBH3ADCY10
SCHEMBL2462203 0.86 ALKBH3 (0.44) CCR2ALKBH3ADCY10
SCHEMBL2460161 0.86 CCR2 (0.53) CCR2ALKBH3CCR5ADCY10PNP
SCHEMBL2425276 0.86 KDM4E (0.46) ALKBH3
SCHEMBL2457171 0.85 ALKBH3 (0.48) CCR2ALKBH3CCR5PNP
SCHEMBL2456143 0.85 CCR2 (0.52) CCR2ALKBH3CCR5ADCY10PNP
SCHEMBL12324673 0.85 IDH1 (0.47) CCR2ADCY10

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
WO-2011114148-A1 4H- [1, 2, 4] TRIAZOLO [5, 1 -B] PYRIMIDIN-7 -ONE DERIVATIVES AS CCR2B RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2011-09-22 — — WO claimed
WO-2011114148-A1 4H- [1, 2, 4] TRIAZOLO [5, 1 -B] PYRIMIDIN-7 -ONE DERIVATIVES AS CCR2B RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2011-09-22 — — WO disclosed