SCHEMBL14745764

SCHEMBL14745764

CCc1cc(C(=O)Oc2c(CC)c(-c3ccc4c(ccn4C)c3)[nH]c(=O)c2C(=O)O)c(=O)[nH]c1-c1ccc2c(ccn2CCO)c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 2/20 0.31
PRKAG1 P54619 1/20 0.31
PRKAA2 P54646 1/20 0.31
PRKAA1 Q13131 1/20 0.31
PRKAB1 Q9Y478 1/20 0.31
PPARG P37231 3/20 0.30
GLO1 Q04760 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 1/20 0.30

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
SCHEMBL14745763 0.87 PRKAG1 (0.32) PRKAG1PRKAA2PRKAA1PRKAB1PPARG
SCHEMBL17597213 0.82 GRK5 (0.37) PRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL14744763 0.81 BCL2 (0.36) PPARGGLO1MTNR1AMTNR1B
SCHEMBL14745245 0.79 MTNR1A (0.35) PPARGGLO1MTNR1AMTNR1B
SCHEMBL14744943 0.78 PRKAG1 (0.40) PRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL14757657 0.77 KDM4E (0.39) PRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL17597214 0.76 GRK5 (0.35)
SCHEMBL17597216 0.75 CYP19A1 (0.34) SERPINE1PPARGMTNR1AMTNR1B
SCHEMBL14745471 0.75 PTGER3 (0.37) PRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL16440981 0.74 MTNR1A (0.40) PPARGGLO1MTNR1AMTNR1B

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-2750504-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC Therapeutics, Inc. (US) 2014-07-09 EP claimed
WO-2013033258-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS, INC. (US) 2013-03-07 WO claimed