SCHEMBL3336786

SCHEMBL3336786

CCC(C=O)CC(CC)CC

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL17715110 0.85 TSHR (0.41) TSHRSMN1; SMN2
SCHEMBL1950732 0.85 TSHR (0.55) TSHRSMN1; SMN2
SCHEMBL14942764 0.82 TSHR (0.52) TSHRSMN1; SMN2
SCHEMBL28129235 0.82 TSHR (0.52) TSHRSMN1; SMN2
SCHEMBL23647050 0.82 TSHR (0.38) TSHRSMN1; SMN2
SCHEMBL11627642 0.82 TSHR (0.65) TSHRSMN1; SMN2
SCHEMBL15611534 0.79 TSHR (0.61) TSHRSMN1; SMN2
SCHEMBL15612002 0.79 TSHR (0.61) TSHRSMN1; SMN2
SCHEMBL10534445 0.79 TSHR (0.55) TSHRSMN1; SMN2
SCHEMBL23412591 0.79 TSHR (0.36) TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809594-B2 Dual catalyst system for the self-condensation of alcohols EASTMAN CHEMICAL COMPANY (US) 2014-08-19 US disclosed
US-20140088326-A1 DUAL CATALYST SYSTEM FOR THE SELF-CONDENSATION OF ALCOHOLS EASTMAN CHEMICAL COMPANY (US) 2014-03-27 US disclosed
US-20100143273-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE APROTIC HYDROCARBON-BASED VOLATILE SOLVENT L'OREAL S.A. (FR) 2010-06-10 US disclosed
EP-2083789-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE APROTIC HYDROCARBON-BASED VOLATILE SOLVENT L'Oréal (FR) 2009-08-05 EP disclosed
WO-2008061985-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE APROTIC HYDROCARBON-BASED VOLATILE SOLVENT L'OREAL (FR) 2008-05-29 WO disclosed