SCHEMBL4978274

SCHEMBL4978274

CCCCC(C(=O)O)C1CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.47
MAPK1 P28482 1/20 0.47
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
CPN1 P15169 4/20 0.41
CPB2 Q96IY4 4/20 0.41
GPR84 Q9NQS5 3/20 0.41
FFAR1 O14842 1/20 0.41
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
MAPT P10636 2/20 0.39
METAP1 P53582 1/20 0.39
DPP4 P27487 1/20 0.38
CHRM1 P11229 1/20 0.38
AKR1A1 P14550 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38

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
SCHEMBL1527354 0.92 CA2 (0.44) CA2MAPK1LCKPPARDZDHHC20
SCHEMBL30801444 0.92 LCK (0.55) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL30023888 0.92 LCK (0.55) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL407615 0.92 CA2 (0.44) CA2MAPK1LCKPPARDZDHHC20
SCHEMBL1456490 0.92 LCK (0.55) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL31607401 0.92 LCK (0.55) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL1457468 0.92 LCK (0.55) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL16046797 0.92 LCK (0.55) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL435610 0.90 CYP2C9 (0.45) CA2MAPK1LCKPPARDZDHHC20
SCHEMBL27981769 0.87 CA2 (0.40) CA2MAPK1LCKPPARDZDHHC20

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013116126-A1 NOVEL LOW MOLECULAR WEIGHT, BIODEGRADABLE CATIONIC LIPIDS FOR OLIGONUCLEOTIDE DELIVERY MERCK SHARP & DOHME CORP. (US) 2013-08-08 WO disclosed
US-7339065-B2 Design and synthesis of optimized ligands for PPAR BETHESDA PHARMACEUTICALS, INC. (US) 2008-03-04 US disclosed
US-20070099969-A1 Design and synthesis of optimized ligands for ppar THE UNIVERSITY OF MISSISSIPPI 2007-05-03 US disclosed
WO-2002076177-A2 DESIGN AND SYNTHESIS OF OPTIMIZED LIGANDS FOR PPAR BETHESDA PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070099969-A1 Design and synthesis of optimized ligands for ppar PPARD, PPARA, PPARG CA2 4715/4885MAPK1 2841/4885LCK 2381/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.