SCHEMBL9753708

SCHEMBL9753708

CC(C)(C)OC(=O)C(CN)CC1(C(=O)NC2(C(=O)O)Cc3ccccc3C2)CCCC1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MME P08473 8/20 0.48
GHSR Q92847 1/20 0.38
CXCR5 P32302 10/20 0.38
F2 P00734 1/20 0.36
PROC P04070 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
SCHEMBL9753713 1.00 MME (0.48) MMEGHSRCXCR5F2PROC
SCHEMBL9753717 1.00 MME (0.48) MMEGHSRCXCR5F2PROC
SCHEMBL9753601 0.86 MME (0.43) MMEGHSRCXCR5
SCHEMBL9753598 0.86 MME (0.43) MMEGHSRCXCR5
SCHEMBL9753945 0.77 MME (0.51) MMECXCR5
SCHEMBL9337097 0.76 CYP2C19 (0.36) MME
SCHEMBL9341047 0.76 CYP2C19 (0.36) MME
SCHEMBL7368344 0.76 CYP2C19 (0.36) MME
SCHEMBL7296981 0.75 CYP2C19 (0.35) MME
SCHEMBL9753816 0.75 MME (0.59) 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