SCHEMBL4692367

SCHEMBL4692367

O=C(O)c1ccc(CCN2C(=O)CC[C@@H]2C=CBr)cc1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 19/20 0.72
PTGER2 P43116 17/20 0.72
PTGER3 P43115 5/20 0.64
PTGER1 P34995 2/20 0.63

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
SCHEMBL4692362 1.00 PTGER4 (0.72) PTGER4PTGER2PTGER3PTGER1
SCHEMBL16057707 0.87 PTGER4 (0.71) PTGER4PTGER2PTGER3PTGER1
SCHEMBL4788484 0.86 PTGER4 (0.58) PTGER4PTGER2PTGER3PTGER1
SCHEMBL5658527 0.86 PTGER4 (0.58) PTGER4PTGER2PTGER3PTGER1
SCHEMBL14069025 0.84 PTGER4 (0.80) PTGER4PTGER2PTGER3PTGER1
SCHEMBL4689250 0.84 PTGER4 (1.00) PTGER4PTGER2PTGER3PTGER1
SCHEMBL4687786 0.84 PTGER4 (1.00) PTGER4PTGER2PTGER3PTGER1
SCHEMBL4687779 0.84 PTGER4 (1.00) PTGER4PTGER2PTGER3PTGER1
SCHEMBL4687505 0.83 PTGER4 (0.81) PTGER4PTGER2PTGER3PTGER1
SCHEMBL4689453 0.83 PTGER4 (0.81) PTGER4PTGER2PTGER3PTGER1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1603874-B1 G-LACTAM DERIVATIVES AS PROSTAGLANDIN AGONISTS SERONO LAB (CH) 2008-05-07 EP disclosed