SCHEMBL9753598

SCHEMBL9753598

CC(C)(C)OC(=O)[C@@H](CN(Cc1ccccc1)Cc1ccccc1)CC1(C(=O)NC2(C(=O)O)Cc3ccccc3C2)CCCC1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MME P08473 10/20 0.43
GHSR Q92847 1/20 0.37
AKT1 P31749 1/20 0.35
CXCR5 P32302 4/20 0.34

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
SCHEMBL9753601 1.00 MME (0.43) MMEGHSRAKT1CXCR5
SCHEMBL9753713 0.86 MME (0.48) MMEGHSRCXCR5
SCHEMBL9753708 0.86 MME (0.48) MMEGHSRCXCR5
SCHEMBL9753717 0.86 MME (0.48) MMEGHSRCXCR5
SCHEMBL7292686 0.85 AKT1 (0.40) MMEAKT1
SCHEMBL9753802 0.85 AKT1 (0.40) MMEAKT1
Hydrochloric Acid SCHEMBL7292680 0.84 AKT1 (0.39) MMEAKT1
Hydrochloric Acid SCHEMBL9337171 0.84 AKT1 (0.39) MMEAKT1
SCHEMBL27349988 0.81 AKT1 (0.41) AKT1
SCHEMBL7297122 0.77 MMP1 (0.42) 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