SCHEMBL8915035

SCHEMBL8915035

CCCCCCCCCCCCCCCCC(CCCCCC)[C](CCCCCCCCCCCC)C(C)(C)CCCCCCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.40
FFAR4 Q5NUL3 2/20 0.39
FFAR1 O14842 2/20 0.39
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39
LMNA P02545 1/20 0.38
GRIK1 P39086 1/20 0.36
GRIK2 Q13002 1/20 0.36
CES2 O00748 3/20 0.35
CES1 P23141 3/20 0.35
PPARG P37231 6/20 0.34
PPARD Q03181 6/20 0.34
PPARA Q07869 6/20 0.34
GPR84 Q9NQS5 5/20 0.34
HDAC11 Q96DB2 5/20 0.34
TSHR P16473 4/20 0.34
ALDH1A1 P00352 2/20 0.34
TLR2 O60603 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
FABP4 P15090 2/20 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
SCHEMBL4208513 0.82 CA2 (0.41) CA2FFAR4FFAR1LMNAGRIK1
SCHEMBL7765562 0.76 FDPS (0.39) CA2FFAR4FFAR1LMNAGRIK1
SCHEMBL19326562 0.73 CES2 (0.42) FFAR4FFAR1CES2CES1PPARG
SCHEMBL19326558 0.73 CES2 (0.42) FFAR4FFAR1CES2CES1PPARG
SCHEMBL19326559 0.73 CES2 (0.42) FFAR4FFAR1CES2CES1PPARG
SCHEMBL23498813 0.70 CA2 (0.48) CA2FFAR4FFAR1LMNAGRIK1
SCHEMBL7767174 0.70 CA2 (0.48) CA2FFAR4FFAR1LMNAGRIK1
SCHEMBL3307047 0.70 CA2 (0.48) CA2FFAR4FFAR1LMNAGRIK1
SCHEMBL16209868 0.70 CA2 (0.48) CA2FFAR4FFAR1LMNAGRIK1
SCHEMBL10519624 0.70 CA2 (0.48) CA2FFAR4FFAR1LMNAGRIK1

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-5618862-A HEATING WITH AGITATION MIXTURE OF BITUMEN, SULFUR-CROSSLINKABLE ELASTOMER, SULFUR-DONATING COUPLING AGENT TO VULCANIZE, ADDING INORGANIC ACID OR ANHYDRIDE ADJUVANT ELF ANTAR FRANCE (FR) 1997-04-08 US disclosed