SCHEMBL13845643

SCHEMBL13845643

CCC1CC(N)CC(C)N1C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
CETP P11597 6/20 0.40
NR1H2 P55055 1/20 0.36
PREP P48147 3/20 0.34
DPP4 P27487 2/20 0.32
CTSK P43235 1/20 0.31
USP2 O75604 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL758017 0.91 CHRM2 (0.46) CHRM2CHRM1CHRM3CETPNR1H2
SCHEMBL9885645 0.91 CHRM2 (0.46) CHRM2CHRM1CHRM3CETPNR1H2
SCHEMBL764555 0.91 CHRM2 (0.46) CHRM2CHRM1CHRM3CETPNR1H2
SCHEMBL31717031 0.86 CHRM2 (0.50) CHRM2CHRM1CHRM3NR1H2PREP
SCHEMBL16876681 0.86 CHRM2 (0.50) CHRM2CHRM1CHRM3NR1H2PREP
SCHEMBL30397638 0.86 CHRM2 (0.50) CHRM2CHRM1CHRM3NR1H2PREP
SCHEMBL14668817 0.85 CHRM2 (0.44) CHRM2CHRM1CHRM3CETPNR1H2
SCHEMBL21456554 0.84 CHRM2 (0.54) CHRM2CHRM1CHRM3CETPNR1H2
SCHEMBL14047316 0.81 NR1H2 (0.51) CHRM2CHRM1CHRM3CETPNR1H2
SCHEMBL24503254 0.80 NR1H2 (0.40) CHRM2CHRM1CHRM3CETPNR1H2

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-2022109492-A1 PYRROLOPYRIDAZINE COMPOUNDS AS KINASE INHIBITORS GOSSAMER BIOSERVICES, INC. (US) 2022-05-27 WO disclosed
EP-1807423-B1 QUINOLINONE-CARBOXAMIDE COMPOUNDS THERAVANCE INC (US) 2009-05-20 EP disclosed