SCHEMBL9753816

SCHEMBL9753816

O=C(O)[C@@H](CCc1ccccc1)CC1(C(=O)NC2(C(=O)O)Cc3ccccc3C2)CCCC1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MME P08473 19/20 0.59
MMP1 P03956 1/20 0.43

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
SCHEMBL9753807 1.00 MME (0.59) MMEMMP1
SCHEMBL9753811 1.00 MME (0.59) MMEMMP1
SCHEMBL9753945 0.88 MME (0.51) MME
SCHEMBL5925066 0.86 MME (0.79) MMEMMP1
SCHEMBL5925045 0.86 MME (0.79) MMEMMP1
SCHEMBL5924893 0.86 MME (0.79) MMEMMP1
SCHEMBL7450171 0.81 MME (0.67) MMEMMP1
SCHEMBL391627 0.76 MME (0.56) MMEMMP1
SCHEMBL9753909 0.76 MME (0.47) MME
SCHEMBL9753450 0.76 MME (0.47) MME

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
WO-1991010644-A1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE DIURETIC AGENTS PFIZER LIMITED (GB) 1991-07-25 WO disclosed