SCHEMBL867225

SCHEMBL867225

CCC(OC(C)=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.45
UTS2R Q9UKP6 2/20 0.45
PPARG P37231 1/20 0.45
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
SLC6A9 P48067 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
AKR1C3 P42330 2/20 0.40
AKR1C2 P52895 2/20 0.40
MAOB P27338 2/20 0.39

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
SCHEMBL4386993 0.81 SIGMAR1 (0.46)
SCHEMBL14547167 0.81 SIGMAR1 (0.46)
SCHEMBL14028741 0.80 ESR1 (0.48)
SCHEMBL27654897 0.78 CES2 (0.50) FFAR1UTS2RCES2CES1AKR1C3
SCHEMBL24397900 0.78 FFAR1 (0.41) FFAR1UTS2RPPARGSLC6A9NPSR1
SCHEMBL2294116 0.78 PABPC1 (0.55)
SCHEMBL9608808 0.78 PABPC1 (0.55)
SCHEMBL664962 0.78 PABPC1 (0.55)
SCHEMBL11837075 0.77 PABPC1 (0.37)
SCHEMBL4242567 0.77 LMNA (0.48)

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
CN-102442974-B Camphor derivative compound, and production method and use thereof WANG BINGJUN 2014-07-23 CN disclosed
US-8609839-B2 Camphor-derived compounds, method for manufacturing the same, and application thereof NATIONAL TSING HUA UNIVERSITY (TW) 2013-12-17 US disclosed
CN-102442974-A Camphor derivative compound, and production method and use thereof BINGJUN WANG 2012-05-09 CN disclosed
US-20120077976-A1 CAMPHOR-DERIVED COMPOUNDS, METHOD FOR MANUFACTURING THE SAME, AND APPLICATION THEREOF NATIONAL TSING HUA UNIVERSITY (TW) 2012-03-29 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-20120077976-A1 CAMPHOR-DERIVED COMPOUNDS, METHOD FOR MANUFACTURING THE SAME, AND APPLICATION THEREOF PDE10A, PDE6H, PRKAR2A FFAR1 633/4885UTS2R 752/4885PPARG 2355/4885

“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.