SCHEMBL3920008

SCHEMBL3920008

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

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
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
SCHEMBL2845427 0.78 TSHR (0.36) TSHRFDPS
SCHEMBL3924037 0.77 SPHK1 (0.42)
SCHEMBL35603 0.76
SCHEMBL2850203 0.74 TSHR (0.33) TSHR
Hydrochloric Acid SCHEMBL2141334 0.73 TSHR (0.39) TSHR
SCHEMBL1252854 0.73 FDPS (0.35) FDPS
SCHEMBL5056952 0.72 TSHR (0.40) TSHR
SCHEMBL9949845 0.72 TSHR (0.40) TSHR
SCHEMBL9950115 0.72 TSHR (0.40) TSHR
SCHEMBL3921732 0.71 TSHR (0.41) TSHRFDPS

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