SCHEMBL8901988

SCHEMBL8901988

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

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
LMNA P02545 1/20 0.36

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
SCHEMBL5675582 0.79 ALDH1A1 (0.39) TSHRLMNA
SCHEMBL4889419 0.73 TSHR (0.56) TSHRLMNA
SCHEMBL4890860 0.73 TSHR (0.40) TSHRLMNA
SCHEMBL598524 0.73 TSHR (0.39) TSHRLMNA
SCHEMBL28639395 0.72 TP53 (0.38) TSHR
SCHEMBL4894799 0.69 THRB (0.43) TSHRLMNA
SCHEMBL8653862 0.69
SCHEMBL28478967 0.69
SCHEMBL2335211 0.69 TSHR (0.58) TSHRLMNA
SCHEMBL14994799 0.69 TSHR (0.58) TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5646236-A POLYAMINE REACTANT; METAL ELECTRODEPOSITION BATHS HOECHST AKTIENGESELLSCHAFT (DE) 1997-07-08 US claimed