SCHEMBL10984643

SCHEMBL10984643

CCCC(C)CC(=O)CC(C)C(C)CC=O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34

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
SCHEMBL7753366 0.82 TSHR (0.34) TSHR
SCHEMBL11559831 0.80 TSHR (0.50) TSHR
SCHEMBL10835140 0.79
SCHEMBL10835263 0.76 TSHR (0.41) TSHR
SCHEMBL11405886 0.74 TSHR (0.44) TSHR
SCHEMBL1783446 0.74 METAP1 (0.37) TSHR
SCHEMBL10835541 0.74 KMT2A (0.44) TSHR
SCHEMBL20838323 0.72 TSHR (0.46) TSHR
SCHEMBL7753360 0.71 TSHR (0.43) TSHR
SCHEMBL231950 0.71

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-4518809-A BRANCHING, DETERGENTS, BIODEGRADATION MONSANTO COMPANY (US) 1985-05-21 US disclosed