SCHEMBL8975273

SCHEMBL8975273

CCCCCC(O)(O)C(C)OC(C)C(O)(O)CCCCC

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FDPS P14324 10/20 0.39
GGPS1 O95749 7/20 0.39
SMPD1 P17405 2/20 0.38
CES1 P23141 1/20 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
SCHEMBL13949279 0.76 FDPS (0.45) FDPSGGPS1SMPD1
SCHEMBL10430892 0.76 FDPS (0.41) FDPSGGPS1SMPD1
SCHEMBL30528715 0.76 FDPS (0.45) FDPSGGPS1SMPD1
SCHEMBL9750773 0.74 OPRM1 (0.32) FDPSGGPS1SMPD1
SCHEMBL3677664 0.73 FDPS (0.43) FDPSGGPS1SMPD1
SCHEMBL21903335 0.73 SPHK1 (0.43) FDPSGGPS1SMPD1
SCHEMBL11875389 0.71 FDPS (0.45) FDPSGGPS1SMPD1
SCHEMBL9715537 0.71 SPHK1 (0.42) FDPSGGPS1
SCHEMBL9405010 0.71 FDPS (0.41) FDPSGGPS1SMPD1
SCHEMBL29051864 0.70 FDPS (0.34) FDPSGGPS1

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-0704420-A1 Process for producing enantiomerically enriched guaifenesin ARCO Chemical Technology, L.P. (US) 1996-04-03 EP disclosed