SCHEMBL4591933

SCHEMBL4591933

OC1CCCC2C(O)CCCC12.OC1CCCCC1O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
TSHR P16473 1/20 0.39
SLC18A3 Q16572 3/20 0.33
GSR P00390 2/20 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
SCHEMBL6848995 0.93 CA1 (0.40) CA1CA2CA4TSHRSLC18A3
SCHEMBL239138 0.93 CA1 (0.40) CA1CA2CA4TSHRSLC18A3
SCHEMBL7913340 0.93 CA1 (0.40) CA1CA2CA4TSHRSLC18A3
SCHEMBL4612530 0.93 CA1 (0.40) CA1CA2CA4TSHRSLC18A3
SCHEMBL8366498 0.93 CA1 (0.40) CA1CA2CA4TSHRSLC18A3
SCHEMBL10237958 0.93 CA1 (0.47) CA1CA2CA4TSHRSLC18A3
SCHEMBL11217184 0.86 TSHR (0.44) CA1CA2CA4TSHRSLC18A3
SCHEMBL561318 0.86 TSHR (0.44) CA1CA2CA4TSHRSLC18A3
SCHEMBL1668954 0.82 CA1 (0.50) CA1CA2CA4TSHRSLC18A3
SCHEMBL9386322 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1918316-B1 Photo-curable resin composition DSM IP ASSETS BV (NL) 2015-09-16 EP disclosed
EP-1918316-A1 Photo-curable resin composition DSMIP Assets B.V. (NL) 2008-05-07 EP disclosed