SCHEMBL30853070

SCHEMBL30853070

C=CC=CCC(O)CCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 2/20 0.50
FAAH O00519 2/20 0.43
GPR84 Q9NQS5 7/20 0.43
SMPD1 P17405 3/20 0.38
TRPA1 O75762 1/20 0.38
DDAH1 O94760 1/20 0.38
GAPDH P04406 1/20 0.38
MAPT P10636 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
PSMD14 O00487 2/20 0.38
PLA2G1B P04054 2/20 0.38
MMP2 P08253 2/20 0.38
ATG4B Q9Y4P1 2/20 0.38
HSP90AA1 P07900 1/20 0.38
RAD52 P43351 1/20 0.38

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
SCHEMBL30005487 1.00 FFAR1 (0.50) FFAR1FFAR4FAAHGPR84SMPD1
SCHEMBL6828223 0.88 FFAR1 (0.54) FFAR1FFAR4FAAHMAPTNFKB1
SCHEMBL30924804 0.85 FFAR1 (0.40) FFAR1FFAR4FAAHGPR84TRPA1
SCHEMBL2639497 0.84 FFAR1 (0.33) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL873099 0.84 FFAR1 (0.33) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL586079 0.84 FFAR1 (0.33) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL873097 0.84 FFAR1 (0.33) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL449788 0.84 FFAR1 (0.64) FFAR1FFAR4FAAHGPR84NFKB1
SCHEMBL449789 0.84 FFAR1 (0.64) FFAR1FFAR4FAAHGPR84NFKB1
SCHEMBL5906871 0.84 FFAR1 (0.49) FFAR1FFAR4FAAHGPR84

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
CN-117924017-A Organic halogen compound having conjugated double bond, method for preparing acetate and alcohol derivative thereof, and compound for synthesizing the compound 信越化学工业株式会社 2024-04-26 CN disclosed