SCHEMBL4563873

SCHEMBL4563873

CC(C)N1CCC(CCCCc2ccc3c(c2)CCN(S(C)(=O)=O)C3)CC1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MOGAT2 Q3SYC2 19/20 0.54
▸ ESR1 P03372 1/20 0.46
▸ ESR2 Q92731 1/20 0.46

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
SCHEMBL4437451 0.85 HRH3 (0.53) MOGAT2ESR1ESR2
SCHEMBL3180461 0.85 GPR119 (0.44) MOGAT2ESR1ESR2
SCHEMBL3188465 0.82 MOGAT2 (0.45) MOGAT2ESR1ESR2
SCHEMBL4437654 0.81 MCHR1 (0.49) MOGAT2ESR1ESR2
SCHEMBL4444433 0.81 ESR2 (0.43) MOGAT2ESR1ESR2
SCHEMBL4434575 0.80 ESR1 (0.42) MOGAT2ESR1ESR2
SCHEMBL3181100 0.77 ESR1 (0.46) MOGAT2ESR1ESR2
SCHEMBL4441827 0.76 ESR1 (0.40) MOGAT2ESR1ESR2
SCHEMBL4437656 0.76 ESR2 (0.46) MOGAT2ESR1ESR2
SCHEMBL3182519 0.75 GPR119 (0.47) ESR1ESR2

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
EP-2114890-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-11-11 — — EP claimed
WO-2008097428-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2008-08-14 — — WO claimed
Send feedback