SCHEMBL11809231

SCHEMBL11809231

CCCCC(CC)C(C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.54
MAPK1 P28482 1/20 0.54
ACE2 Q9BYF1 1/20 0.42
CA1 P00915 4/20 0.42
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 1/20 0.42
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
MAPT P10636 1/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
CHRM1 P11229 1/20 0.39
AKR1A1 P14550 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39

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
SCHEMBL27166017 0.94 GPR84 (0.50) CA2MAPK1ACE2CA1GPR84
SCHEMBL28711693 0.90 CA2 (0.48) CA2MAPK1ACE2CA1GPR84
SCHEMBL8693397 0.86 CHRM1 (0.48) CA2MAPK1ACE2GPR84FFAR1
SCHEMBL30514338 0.83 CA2 (0.45) CA2MAPK1ACE2CA1GPR84
SCHEMBL29140004 0.83 CA2 (0.45) CA2MAPK1ACE2CA1GPR84
SCHEMBL9540324 0.83 CYP1A2 (0.43) GPR84FFAR1PPARDTDP1
SCHEMBL18595176 0.83 GPR84 (0.57) ACE2CA1GPR84FFAR1SLC1A2
SCHEMBL18557332 0.83 GPR84 (0.57) ACE2CA1GPR84FFAR1SLC1A2
SCHEMBL18595304 0.83 GPR84 (0.57) ACE2CA1GPR84FFAR1SLC1A2
SCHEMBL18595218 0.83 GPR84 (0.57) ACE2CA1GPR84FFAR1SLC1A2

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
EP-4641061-A1 OIL-WELL METAL PIPE NIPPON STEEL CORPORATION (JP) 2025-10-29 EP disclosed
WO-2024135464-A1 OIL-WELL METAL PIPE 日本製鉄株式会社 2024-06-27 WO disclosed
US-3932285-A MONOCARBOXYLIC ACID TENNECO CHEMICALS, INC. (US) 1976-01-13 US disclosed