SCHEMBL9821111

SCHEMBL9821111

CC1CCCC(C)(C)C1C(=O)O.[Mo]

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 3/20 0.44
CYP1A2 P05177 1/20 0.34
EPHX1 P07099 1/20 0.32
APLNR P35414 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
FFAR3 O14843 1/20 0.30

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
SCHEMBL7169835 0.98 UGT2B7 (0.45) UGT2B7CYP1A2EPHX1APLNRSLC1A2
SCHEMBL4607755 0.98 UGT2B7 (0.45) UGT2B7CYP1A2EPHX1APLNRSLC1A2
SCHEMBL4607753 0.98 UGT2B7 (0.45) UGT2B7CYP1A2EPHX1APLNRSLC1A2
SCHEMBL4152574 0.98 UGT2B7 (0.45) UGT2B7CYP1A2EPHX1APLNRSLC1A2
SCHEMBL4152571 0.98 UGT2B7 (0.45) UGT2B7CYP1A2EPHX1APLNRSLC1A2
SCHEMBL4147353 0.98 UGT2B7 (0.45) UGT2B7CYP1A2EPHX1APLNRSLC1A2
SCHEMBL28166839 0.83 UGT2B7 (0.35) UGT2B7CYP1A2EPHX1
SCHEMBL4606059 0.82 UGT2B7 (0.34) UGT2B7CYP1A2EPHX1
SCHEMBL21441575 0.82 UGT2B7 (0.34) UGT2B7CYP1A2EPHX1
SCHEMBL4605622 0.82 UGT2B7 (0.34) UGT2B7CYP1A2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0279090-B1 GASOLINE COMPOSITIONS CONTAINING HEXAVALENT MOLYBDENUM AMOCO CORPORATION (US) 1991-11-27 EP disclosed
EP-0279090-A1 Gasoline compositions containing hexavalent molybdenum AMOCO CORPORATION (US) 1988-08-24 EP disclosed
US-4647293-A Gasoline compositions containing hexavalent molybdenum Magidson, William H. (US) 1987-03-03 US disclosed