SCHEMBL3922982

SCHEMBL3922982

CCC(N(CC)CC)N(CC(C)O)CC(C)O

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
KCNA5 P22460 1/20 0.30
FDPS P14324 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
SCHEMBL3921732 0.95 TSHR (0.41) TSHRKCNA5FDPS
SCHEMBL3929219 0.91 TSHR (0.38) TSHR
SCHEMBL3931452 0.81 TSHR (0.41) TSHRKCNA5
SCHEMBL1252854 0.79 FDPS (0.35) FDPS
SCHEMBL3929224 0.78 TSHR (0.31) TSHR
SCHEMBL20243279 0.77 TSHR (0.40) TSHRKCNA5FDPS
SCHEMBL2058469 0.77 TSHR (0.40) TSHRKCNA5FDPS
SCHEMBL3919951 0.77 PLA2G1B (0.44)
SCHEMBL3924155 0.77 TSHR (0.33) TSHR
SCHEMBL3928036 0.76 TSHR (0.36) TSHR

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
US-7572837-B2 Process for the production of flexible polyurethane foams TOSOH CORPORATION (JP) 2009-08-11 US disclosed
US-20030144371-A1 Catalyzing the copolymerization in presence of imidazole compounds, free of tin comound, forming polyetherurethane copolymers TOSOH CORPORATION (JP) 2003-07-31 US disclosed
EP-1312630-A1 Process for the production of flexible polyurethane foams Tosoh Corporation (JP) 2003-05-21 EP disclosed