SCHEMBL30695271

SCHEMBL30695271

CCCC=C(C=CC(=O)O)CC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 6/20 0.41
TSHR P16473 2/20 0.39
TP53 P04637 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
EGLN3 Q9H6Z9 1/20 0.39
GRIK1 P39086 1/20 0.35
GRIK2 Q13002 1/20 0.35
PTPN1 P18031 1/20 0.33
PPARA Q07869 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
EP300 Q09472 1/20 0.32
FFAR3 O14843 1/20 0.32

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
SCHEMBL30695273 1.00 HCAR2 (0.41) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL13347104 1.00 HCAR2 (0.41) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL23795446 0.86 EP300 (0.50) HCAR2PTPN1PPARAEP300
SCHEMBL3661608 0.86 EP300 (0.50) HCAR2PTPN1PPARAEP300
SCHEMBL26967507 0.83 ALDH1A1 (0.32) GRIK1GRIK2
SCHEMBL27255457 0.83 ALDH1A1 (0.32) GRIK1GRIK2
SCHEMBL8920771 0.82 TSHR (0.43) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL8920758 0.82 TSHR (0.43) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL28923090 0.77 HCAR2 (0.43) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL9367291 0.77 TSHR (0.47) HCAR2TSHRTP53EGLN1EGLN3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119317696-A Perfume mixture (V) 西姆莱斯股份公司 2025-01-14 CN claimed
EP-4532646-A1 A FRAGRANCE MIXTURE (V) Symrise AG (DE) 2025-04-09 EP disclosed
CN-119317696-A Perfume mixture (V) 西姆莱斯股份公司 2025-01-14 CN disclosed
CN-119317696-A Perfume mixture (V) 西姆莱斯股份公司 2025-01-14 CN disclosed
WO-2023232243-A1 A FRAGRANCE MIXTURE (V) SYMRISE AG (DE) 2023-12-07 WO disclosed