SCHEMBL19475008

SCHEMBL19475008

CCCCCC[CH]CCCCCC(O)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.53
FFAR1 O14842 2/20 0.53
FAAH O00519 3/20 0.46
SOAT1 P35610 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 2/20 0.42
FFAR4 Q5NUL3 1/20 0.42
PPARG P37231 1/20 0.41

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
SCHEMBL19474989 1.00 GPR84 (0.53) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL5974006 0.89 FAAH (0.59) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL29634344 0.89 FAAH (0.59) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL10481737 0.89 FAAH (0.59) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL6748934 0.89 FAAH (0.59) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL7854038 0.89 FAAH (0.59) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL7854030 0.89 FAAH (0.59) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL6748929 0.89 FAAH (0.59) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL6897483 0.89 FAAH (0.59) GPR84FFAR1FAAHSOAT1MEN1
SCHEMBL15007874 0.89 GPR84 (0.65) GPR84FFAR1FFAR4

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
WO-2017184558-A1 NOVEL PROMYSALIN ANALOGUES AND METHODS OF USE THEREOF TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2017-10-26 WO claimed
WO-2017184558-A1 NOVEL PROMYSALIN ANALOGUES AND METHODS OF USE THEREOF TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2017-10-26 WO disclosed