SCHEMBL4669404

SCHEMBL4669404

Cc1coc2c(Cl)nc([C@H](C)O)cc12

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.31
MAOA P21397 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
SCHEMBL4669406 1.00 KCNA3 (0.31) KCNA3MAOA
SCHEMBL6662967 0.86 MAOA (0.33) KCNA3MAOA
SCHEMBL6666149 0.83
SCHEMBL6663610 0.81
SCHEMBL6668562 0.80 PDE2A (0.31)
SCHEMBL4670952 0.73 ALDH1A1 (0.34) KCNA3MAOA
SCHEMBL6640434 0.72 MAOA (0.31) MAOA
SCHEMBL6662995 0.71 FFAR4 (0.32) MAOA
SCHEMBL4797557 0.71 HTR1B (0.31)
SCHEMBL4796851 0.71 HTR1B (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1116795-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE PYRIDINEETHANOL DERIVATIVES KANEKA CORP (JP) 2008-03-12 EP disclosed
US-7329518-B2 Enzyme for producing optically active pyridineethanol derivatives KANEKA CORPORATION (JP) 2008-02-12 US disclosed
US-20040043460-A1 Process for producing optically active pyridineethanol derivatives KANEKA CORPORATION (JP) 2004-03-04 US disclosed
EP-1116795-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE PYRIDINEETHANOL DERIVATIVES KANEKA CORPORATION (JP) 2001-07-18 EP disclosed