SCHEMBL6514004

SCHEMBL6514004

CCCCCCC(O)CCC=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.55
FFAR1 O14842 2/20 0.55
TSHR P16473 2/20 0.54
GPR84 Q9NQS5 7/20 0.52
NFKB1 P19838 1/20 0.48
FAAH O00519 2/20 0.48
TRPV1 Q8NER1 1/20 0.48
TRPA1 O75762 1/20 0.46
DDAH1 O94760 1/20 0.46
GAPDH P04406 1/20 0.46
MAPT P10636 1/20 0.46
FDPS P14324 3/20 0.45

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
SCHEMBL28345168 1.00 FFAR4 (0.55) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL7913952 1.00 FFAR4 (0.55) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL8687254 1.00 FFAR4 (0.55) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL3486633 0.98 FFAR4 (0.52) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL27204 0.92 TSHR (0.67) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL15508284 0.92 TSHR (0.67) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL16706242 0.92 TSHR (0.67) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL11798450 0.92 TSHR (0.67) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL19816345 0.92 TSHR (0.67) FFAR4FFAR1TSHRGPR84NFKB1
SCHEMBL21530621 0.92 TSHR (0.60) FFAR4FFAR1TSHRGPR84NFKB1

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
CN-114540379-B Gene participating in synthesis of peach fruit fragrance type aromatic substances and application thereof 浙江大学 2023-07-21 CN disclosed
CN-114540379-A Gene participating in synthesis of peach fruit fragrance type aromatic substances and application thereof 浙江大学 2022-05-27 CN disclosed
US-20050004225-A1 Oxidoreductase inhibitors and methods of screening and using thereof CITY OF HOPE 2005-01-06 US disclosed