SCHEMBL25344179

SCHEMBL25344179

CCCCCCCCC(CCCC)(C(=O)O)C(CC(=O)O)(OCCCC)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.38
S1PR4 O95977 1/20 0.37
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
S1PR5 Q9H228 1/20 0.37
HSPD1 P10809 1/20 0.36
BLM P54132 1/20 0.36
HSPE1 P61604 1/20 0.36
TDP1 Q9NUW8 3/20 0.36
FFAR1 O14842 2/20 0.36
CPT2 P23786 1/20 0.36
CES2 O00748 1/20 0.36
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

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
SCHEMBL25343795 0.98 S1PR4 (0.38) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL101729 0.95 NAAA (0.39) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL4731035 0.95 NAAA (0.39) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL4732300 0.95 NAAA (0.39) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL4731154 0.95 NAAA (0.39) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL1420373 0.95 NAAA (0.39) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL11213772 0.95 NAAA (0.39) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL688123 0.95 NAAA (0.39) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL2486883 0.95 NAAA (0.39) PAMS1PR4S1PR1S1PR3S1PR5
SCHEMBL588169 0.95 ALDH1A1 (0.36) PAMS1PR4S1PR1S1PR3S1PR5

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
EP-3255086-B1 ENVIRONMENTALLY FRIENDLY PLASTICIZER COMPOSITION, AND VINYL CHLORIDE RESIN COMPOSITION CONTAINING SAME HANWHA CHEMICAL CORP (KR) 2023-06-28 EP claimed