SCHEMBL4582592

SCHEMBL4582592

CC(C)(C)OC(=O)ON1CCC(NC(=O)c2ccc(Cl)s2)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.42
KMT2A Q03164 3/20 0.40
MAPK1 P28482 2/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
USP30 Q70CQ3 2/20 0.38
F2 P00734 1/20 0.37
NPC1 O15118 1/20 0.36

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
SCHEMBL3449130 0.83 USP30 (0.55) F10MAPK1RAB9AHTTUSP30
SCHEMBL3449128 0.83 USP30 (0.55) F10MAPK1RAB9AHTTUSP30
SCHEMBL4435200 0.81 F10 (0.44) F10KMT2AMAPK1LMNAF2
SCHEMBL4435115 0.81 F10 (0.42) F10KMT2AMAPK1LMNAF2
SCHEMBL8290168 0.79 USP30 (0.57) F10KMT2ARAB9AMEN1GAA
SCHEMBL4435125 0.78 F10 (0.41) F10F2
SCHEMBL4436565 0.78 F10 (0.42) F10KMT2AMAPK1LMNARAB9A
SCHEMBL4442146 0.77 F10 (0.38) F10KMT2AMAPK1LMNARAB9A
SCHEMBL4436005 0.76 F10 (0.40) F10KMT2AMAPK1LMNARAB9A
SCHEMBL4438714 0.75 F10 (0.43) F10MAPK1

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