SCHEMBL12191925

SCHEMBL12191925

CCCCOc1cc(CC(C)C)ccc1-c1cccc(F)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.38
NLRP3 Q96P20 1/20 0.38
AGTR2 P50052 2/20 0.38
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
LTB4R2 Q9NPC1 3/20 0.37
PTPN11 Q06124 2/20 0.37
LTB4R Q15722 2/20 0.37
CYP1A2 P05177 1/20 0.36
CYP19A1 P11511 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
CNR2 P34972 1/20 0.36

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
SCHEMBL12221501 0.87 CYP11B1 (0.40) NLRP3CYP11B1CYP11B2LTB4R2PTPN11
SCHEMBL12191932 0.84 CYP1A2 (0.46) CYP11B1CYP11B2CYP1A2CYP2C9CYP2C19
SCHEMBL12191895 0.83 MEN1 (0.37) PPARGAGTR2PTPN11CNR2
SCHEMBL12968482 0.79 CYP1A2 (0.50) CYP1A2CYP19A1CYP2C9CYP2C19
SCHEMBL20782276 0.76 GABRA1 (0.46) PPARGCYP11B1CYP11B2LTB4RCYP1A2
SCHEMBL12192913 0.75 FFAR1 (0.38)
SCHEMBL2500615 0.74 FFAR1 (0.54)
SCHEMBL2499268 0.74 FFAR1 (0.54)
SCHEMBL12192810 0.73 SIGMAR1 (0.37)
SCHEMBL11996441 0.73 TAAR1 (0.39) PPARGCYP11B1CYP11B2LTB4R2PTPN11

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-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 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-20090137561-A1 Substituted biphenyl GPR40 modulators GPR119, GPR65, GPR55 PPARG 13/4885NLRP3 1845/4885AGTR2 112/4885

“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.