SCHEMBL9067313

SCHEMBL9067313

C=C(C)C(=O)NC(C)N(C)C.C=CC(=O)NC(C)N(C)C.C=CC(=O)NC(C)N(CC)CC

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
TGFBR1 P36897 1/20 0.33

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
SCHEMBL7633568 1.00 TSHR (0.39) TSHRTGFBR1
SCHEMBL8040760 1.00 TSHR (0.39) TSHRTGFBR1
SCHEMBL8040743 0.91 TSHR (0.36) TSHRTGFBR1
SCHEMBL7636006 0.90 TGFBR1 (0.40) TGFBR1
SCHEMBL8012768 0.90 TSHR (0.47) TSHR
SCHEMBL2158113 0.83 TSHR (0.54) TSHR
SCHEMBL2766799 0.83 TGFBR1 (0.44) TSHRTGFBR1
Hydrochloric Acid SCHEMBL11063367 0.82 TSHR (0.52) TSHR
Hydrochloric Acid SCHEMBL28937717 0.82 TGFBR1 (0.43) TSHRTGFBR1
SCHEMBL7630925 0.80 TSHR (0.34) TSHRTGFBR1

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-0689568-A1 BINDER SYSTEMS FOR USE IN ELECTRO-DIP COATING BASF Lacke + Farben Aktiengesellschaft (DE) 1996-01-03 EP disclosed
WO-1994021736-A1 BINDER SYSTEMS FOR USE IN ELECTRO-DIP COATING BASF LACKE + FARBEN AG (DE) 1994-09-29 WO disclosed