SCHEMBL1847687

SCHEMBL1847687

Cn1cc(Cc2nn(C(C)(C(=O)O)c3ccccc3)c(=O)c3ccccc23)c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 9/20 0.64
▸ GPR84 Q9NQS5 1/20 0.45
▸ GRM2 Q14416 1/20 0.39
▸ GRM3 Q14832 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ APAF1 O14727 1/20 0.37
▸ TSHR P16473 1/20 0.37

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
SCHEMBL1852376 0.82 CMA1 (0.60) CMA1LMNATSHR
SCHEMBL18887417 0.81 CMA1 (0.60) CMA1GPR84GRM2GRM3
SCHEMBL7951727 0.78 CMA1 (1.00) CMA1GPR84TSHR
SCHEMBL7959067 0.77 CMA1 (0.85) CMA1GPR84TSHR
SCHEMBL3418056 0.74 CMA1 (1.00) CMA1GPR84POLB
SCHEMBL18900854 0.74 CMA1 (0.76) CMA1GPR84TSHR
SCHEMBL7963672 0.73 CMA1 (0.67) CMA1GPR84TSHR
SCHEMBL7960524 0.72 CMA1 (1.00) CMA1GPR84POLB
SCHEMBL7966175 0.71 CMA1 (0.81) CMA1GPR84LMNAPOLB
SCHEMBL7959611 0.71 CMA1 (0.77) CMA1LMNATSHR

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
EP-2323991-A2 CHYMASE INHIBITORS Boehringer Ingelheim International GmbH (DE) 2011-05-25 — — EP disclosed
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