SCHEMBL8034283

SCHEMBL8034283

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

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
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
SCHEMBL7630925 1.00 TSHR (0.34) TSHRTGFBR1
SCHEMBL10628352 0.93 TSHR (0.39) TSHRTGFBR1
SCHEMBL7629624 0.90 TSHR (0.41) TSHR
SCHEMBL8145684 0.90 TGFBR1 (0.39) TGFBR1
SCHEMBL8040743 0.90 TSHR (0.36) TSHRTGFBR1
SCHEMBL3285064 0.84 TSHR (0.47) TSHR
SCHEMBL3280973 0.84 TGFBR1 (0.43) TGFBR1
Hydrochloric Acid SCHEMBL29162350 0.82 TGFBR1 (0.42) TGFBR1
Hydrochloric Acid SCHEMBL29008141 0.82 TSHR (0.45) TSHR
SCHEMBL34096 0.82 TGFBR1 (0.44) 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-0988154-A1 COATING COMPOSITION AND PRINTING MEDIUM PPG Industries Ohio, Inc. (US) 2000-03-29 EP disclosed
WO-1998056591-A1 COATING COMPOSITION AND PRINTING MEDIUM PPG INDUSTRIES OHIO, INC. (US) 1998-12-17 WO disclosed