SCHEMBL4582915

SCHEMBL4582915

CN1CCc2ccc(C(=O)N3CC(NC(=O)c4ccc(Cl)s4)C(OC(=O)O)C3)cc2CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.46
F2 P00734 3/20 0.43
F11 P03951 2/20 0.41
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 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
SCHEMBL8487514 0.91 F10 (0.45) F10F2F11LMNAMAPK1
SCHEMBL3309135 0.91 F10 (0.45) F10F2F11LMNAMAPK1
SCHEMBL4585098 0.89 F10 (0.46) F10F2F11LMNAMAPK1
SCHEMBL3305811 0.89 F10 (0.44) F10F2F11LMNAMAPK1
SCHEMBL8502118 0.89 F10 (0.44) F10F2F11LMNAMAPK1
SCHEMBL4583305 0.87 F10 (0.45) F10F2F11LMNAKMT2A
SCHEMBL8501998 0.87 F10 (0.48) F10F2F11LMNAMAPK1
SCHEMBL3308478 0.87 F10 (0.48) F10F2F11LMNAMAPK1
SCHEMBL8476746 0.87 F10 (0.43) F10F2F11LMNAMAPK1
SCHEMBL13674692 0.87 F10 (0.47) F10F2F11LMNAMAPK1

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-2132193-B1 SUBSTITUTED PYRROLIDINE AMIDES, THE PRODUCTION THEREOF, AND THE USE THEREOF AS MEDICATIONS BOEHRINGER INGELHEIM INT (DE) 2012-10-24 EP disclosed
EP-1975165-A1 Substituted pyrrolidinamides, their production and utilisation as medicine Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2008-10-01 EP disclosed