SCHEMBL6252151

SCHEMBL6252151

C=CCC(CC)(CC=C)CCCCCCCCCCC(CC)(CC=C)CC=C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL28222806 0.89 TSHR (0.44) TSHRALDH1A1
SCHEMBL16162170 0.86 TSHR (0.41) TSHRALDH1A1
SCHEMBL30069102 0.84
SCHEMBL17479363 0.83 TSHR (0.48) TSHRALDH1A1
SCHEMBL10456150 0.82 TSHR (0.35) TSHRALDH1A1
SCHEMBL1539720 0.81 TSHR (0.35) TSHRALDH1A1
SCHEMBL8343493 0.81 TSHR (0.35) TSHRALDH1A1
SCHEMBL23132563 0.80 TSHR (0.44) TSHRALDH1A1
SCHEMBL4791142 0.80 TSHR (0.44) TSHRALDH1A1
SCHEMBL24659224 0.79

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-1572189-A1 METHOD OF LOWERING CRP AND REDUCING SYSTEMIC INFLAMMATION Warner-Lambert Company LLC (US) 2005-09-14 EP disclosed
WO-2004045596-A1 METHOD OF LOWERING CRP AND REDUCING SYSTEMIC INFLAMMATION WARNER-LAMBERT COMPANY LLC (US) 2004-06-03 WO disclosed