SCHEMBL11289986

SCHEMBL11289986

CCOC(=O)C1(CCCOCCc2ccc(Cl)cc2)CO1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.65
LMNA P02545 2/20 0.65
ABCB11 O95342 1/20 0.65
MAPK1 P28482 1/20 0.65
POLB P06746 1/20 0.40
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 3/20 0.39
HTT P42858 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
OPRM1 P35372 1/20 0.38
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CHRM2 P08172 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
SCHEMBL11297005 0.94 LMNA (0.67) MAPTLMNAABCB11MAPK1POLB
SCHEMBL11299997 0.92 LMNA (0.70) MAPTLMNAABCB11MAPK1POLB
SCHEMBL11264433 0.89 LMNA (0.68) MAPTLMNAABCB11MAPK1POLB
SCHEMBL11293008 0.88 ABCB11 (0.61) MAPTLMNAABCB11MAPK1POLB
SCHEMBL11296901 0.88 LMNA (0.61) MAPTLMNAABCB11MAPK1POLB
SCHEMBL11268901 0.87 LMNA (0.72) MAPTLMNAABCB11MAPK1POLB
SCHEMBL4731655 0.87 LMNA (0.72) MAPTLMNAABCB11MAPK1POLB
SCHEMBL11296871 0.84 ABCB11 (0.56) MAPTLMNAABCB11MAPK1KMT2A
SCHEMBL11289971 0.84 LMNA (0.58) MAPTLMNAABCB11MAPK1POLB
SCHEMBL11293789 0.83 LMNA (0.52) MAPTLMNAABCB11MAPK1POLB

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
US-4337267-A HYPOKETONEMIC, HYPOGLYCEMIC, ANTIDIABETIC BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-06-29 US disclosed