SCHEMBL8619375

SCHEMBL8619375

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

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
MME P08473 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31
ACE2 Q9BYF1 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL1660114 0.81 TSHR (0.53) TSHRTDP1
SCHEMBL11223297 0.79 TSHR (0.42) TSHR
SCHEMBL15142570 0.75
SCHEMBL11423545 0.75
SCHEMBL20836758 0.75
SCHEMBL15141638 0.75
SCHEMBL12214929 0.75
SCHEMBL101393 0.75
SCHEMBL598787 0.73 TSHR (0.37) TSHR
SCHEMBL29233381 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0839179-A1 CONCENTRATED, WATER DISPERSIBLE, STABLE, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-05-06 EP claimed
WO-1997003170-A1 CONCENTRATED, WATER DISPERSIBLE, STABLE, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO claimed
EP-3895651-A1 ELASTOMER THERMOPLASTIC ANTIMICROBIAL FILM, COMPOSITION AND MANUFACTURING METHOD FOR OBTAINING SAME Hexis (FR) 2021-10-20 EP disclosed