SCHEMBL29948915

SCHEMBL29948915

CCCCCCCCCCCCCCC(=O)C(=O)NC(C(=O)O)C(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 6/20 1.00
PLA2G5 P39877 3/20 1.00
SMN1; SMN2 Q16637 1/20 0.55
TP53 P04637 1/20 0.49
PLA2G4A P47712 1/20 0.49
CES2 O00748 4/20 0.48
CES1 P23141 4/20 0.48
FAAH O00519 2/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
PPARG P37231 2/20 0.47
PPARA Q07869 1/20 0.47

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
SCHEMBL30798618 1.00 PLA2G2A (1.00) PLA2G2APLA2G5SMN1; SMN2TP53PLA2G4A
SCHEMBL2118667 0.86 PLA2G2A (0.76) PLA2G2APLA2G5SMN1; SMN2PLA2G4ACES2
SCHEMBL2118676 0.86 PLA2G2A (0.76) PLA2G2APLA2G5SMN1; SMN2PLA2G4ACES2
SCHEMBL2119435 0.83 PLA2G2A (0.70) PLA2G2APLA2G5SMN1; SMN2TP53PLA2G4A
SCHEMBL2119429 0.83 PLA2G2A (0.70) PLA2G2APLA2G5SMN1; SMN2TP53PLA2G4A
SCHEMBL25192254 0.83 PLA2G2A (0.71) PLA2G2APLA2G5SMN1; SMN2TP53FAAH
SCHEMBL15697666 0.83 PLA2G2A (0.71) PLA2G2APLA2G5SMN1; SMN2TP53FAAH
SCHEMBL15649018 0.83 PLA2G2A (0.71) PLA2G2APLA2G5SMN1; SMN2TP53FAAH
SCHEMBL9666963 0.83 PLA2G2A (0.71) PLA2G2APLA2G5SMN1; SMN2TP53FAAH
SCHEMBL543200 0.83 PLA2G2A (0.71) PLA2G2APLA2G5SMN1; SMN2TP53FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4313020-A1 MANAGING THE ACUTE AND LONG-TERM EFFECTS OF CORONAVIRAL INFECTIONS AND COMPOSITIONS RELATED THERETO Emory University (US) 2024-02-07 EP disclosed
WO-2022204517-A1 MANAGING THE ACUTE AND LONG-TERM EFFECTS OF CORONAVIRAL INFECTIONS AND COMPOSITIONS RELATED THERETO EMORY UNIVERSITY (US) 2022-09-29 WO disclosed