SCHEMBL7726273

SCHEMBL7726273

CCC1(C)CC(C(CCCCCCCC(=O)O)C(=O)O)C(C)C(C)(CC)N1C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.39
FFAR1 O14842 2/20 0.39
PTGER4 P35408 8/20 0.35
PTGER2 P43116 7/20 0.35
PTGER3 P43115 7/20 0.35
TBXA2R P21731 1/20 0.34
PTGFR P43088 1/20 0.34
ALDH1A1 P00352 1/20 0.33
PTGER1 P34995 1/20 0.31
TBXAS1 P24557 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
SCHEMBL7768567 0.88 FFAR4 (0.35) FFAR4FFAR1PTGER4PTGER2PTGER3
SCHEMBL28264669 0.79 FFAR4 (0.39) FFAR4FFAR1PTGER4PTGER2PTGER3
SCHEMBL28293420 0.71 PTGER4 (0.37) FFAR4FFAR1PTGER4PTGER2PTGER3
SCHEMBL1019749 0.71 FFAR4 (0.41) FFAR4FFAR1PTGER4PTGER2PTGER3
SCHEMBL756072 0.66 FFAR4 (0.37) FFAR4FFAR1ALDH1A1
SCHEMBL1724159 0.66 FFAR4 (0.42) FFAR4FFAR1PTGER4PTGER2PTGER3
SCHEMBL1160551 0.65 FFAR4 (0.37) FFAR4FFAR1PTGER4PTGER2PTGER3
SCHEMBL6310021 0.65 GSTK1 (0.39) FFAR4FFAR1ALDH1A1
SCHEMBL11294043 0.65 GSTK1 (0.39) FFAR4FFAR1ALDH1A1
SCHEMBL28164309 0.65 GSTK1 (0.39) FFAR4FFAR1ALDH1A1

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-6403679-B1 PHOTOSTABILIZERS FOR AGRICULTURAL FILMS GREAT LAKES CHEMICAL (EUROPE) GMBH (CH) 2002-06-11 US disclosed