SCHEMBL25501505

SCHEMBL25501505

C=C(C)C[C@@H](O)CCCCCCCCCCC

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.59
FFAR1 O14842 2/20 0.47
FFAR4 Q5NUL3 1/20 0.47
SPHK1 Q9NYA1 2/20 0.42
PSMD14 O00487 2/20 0.42
PLA2G1B P04054 2/20 0.42
MMP2 P08253 2/20 0.42
ATG4B Q9Y4P1 2/20 0.42
HSP90AA1 P07900 1/20 0.42
RAD52 P43351 1/20 0.42
LMNA P02545 1/20 0.41
NFKB1 P19838 1/20 0.41
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL26667095 0.98 GPR84 (0.55) GPR84FFAR1FFAR4SPHK1PSMD14
SCHEMBL10534502 0.91 GPR84 (0.47) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL27635638 0.83 GPR84 (0.39) GPR84FFAR1FFAR4LMNACYP3A4
SCHEMBL9257876 0.81
SCHEMBL9014471 0.81 GPR84 (0.57) GPR84FFAR1FFAR4SPHK1PSMD14
SCHEMBL8577154 0.80 GPR84 (0.61) GPR84FFAR1FFAR4SPHK1PSMD14
SCHEMBL669622 0.78 GPR84 (0.70) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL22391516 0.78 GPR84 (0.70) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL22806886 0.78 ACE2 (0.47) GPR84FFAR1SPHK1LMNA
SCHEMBL23789287 0.78 FFAR1 (0.67) GPR84FFAR1FFAR4SPHK1PSMD14

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-4180447-A1 CARRIER PROTEIN SUBJECTED TO SITE-DIRECTED MUTATION AND USE THEREOF IN PREPARATION OF VACCINE Cansino Biologics Inc. (CN) 2023-05-17 EP disclosed