SCHEMBL17930146

SCHEMBL17930146

CC(=O)OC[C@H](C)C/C=C/CCCCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.47
PPARD Q03181 4/20 0.47
PPARA Q07869 4/20 0.47
TERT O14746 3/20 0.47
PTPN1 P18031 3/20 0.47
F7 P08709 3/20 0.47
F3 P13726 3/20 0.47
MAPT P10636 3/20 0.47
BLM P54132 2/20 0.47
HSD17B10 Q99714 2/20 0.47
FABP4 P15090 2/20 0.47
PTGS1 P23219 2/20 0.47
USP2 O75604 2/20 0.47
LMNA P02545 2/20 0.47
RECQL P46063 2/20 0.47
DUSP3 P51452 2/20 0.47
GMNN O75496 1/20 0.47
CYP1A2 P05177 1/20 0.47
POLB P06746 1/20 0.47
CYP2C9 P11712 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
SCHEMBL20859600 0.98 MAPT (0.50) PPARGPPARDPPARATERTPTPN1
SCHEMBL7556359 0.84 FFAR1 (0.50) PPARGPPARDPPARATERTPTPN1
SCHEMBL7948558 0.84 FFAR1 (0.50) PPARGPPARDPPARATERTPTPN1
SCHEMBL9968740 0.79 PPARG (0.59) PPARGPPARDPPARATERTPTPN1
SCHEMBL30513702 0.78 PPARG (0.62) PPARGPPARDPPARATERTPTPN1
SCHEMBL2207906 0.77 PPARG (0.60) PPARGPPARDPPARATERTPTPN1
SCHEMBL15722839 0.77 LMNA (0.39) PTPN1MAPTHSD17B10USP2LMNA
SCHEMBL2207902 0.77 PPARG (0.60) PPARGPPARDPPARATERTPTPN1
SCHEMBL11896459 0.77 LMNA (0.39) PTPN1MAPTHSD17B10USP2LMNA
SCHEMBL11896458 0.77 LMNA (0.39) PTPN1MAPTHSD17B10USP2LMNA

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
US-9714271-B2 Cyclosporine analogue molecules modified at amino acid 1 and 3 CONTRAVIR PHARMACEUTICALS, INC. (US) 2017-07-25 US disclosed
US-20160207961-A1 Cyclosporine Analogue Molecules Modified At Amino Acid 1 and 3 ACHILLE LIFE SCIENCES LIMITED (GB) 2016-07-21 US 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-20160207961-A1 Cyclosporine Analogue Molecules Modified At Amino Acid 1 and 3 FKBP1A, CHP1, FKBP3 PPARG 3313/4885PPARD 3410/4885PPARA 1929/4885

“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.