SCHEMBL7074742

SCHEMBL7074742

C=CC[C@H]([O])[C@@H]([O])CC=C

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
GRIK1 P39086 2/20 0.32
GRIK2 Q13002 2/20 0.32
CYP2C19 P33261 1/20 0.31
CPA1 P15085 1/20 0.31

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
SCHEMBL4945053 0.77
SCHEMBL5881412 0.77
SCHEMBL7078635 0.75 TSHR (0.39) TSHR
SCHEMBL10745017 0.74
SCHEMBL15824297 0.72
SCHEMBL181264 0.72
SCHEMBL6971914 0.72
SCHEMBL1435251 0.72
SCHEMBL7074521 0.69
SCHEMBL2136788 0.69

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-1354886-A1 Process for the preparation of tertiary phosphines Bayer Aktiengesellschaft (DE) 2003-10-22 EP disclosed