SCHEMBL7094947

SCHEMBL7094947

CC(C)(C)OC(=O)C(C)(C)Oc1ccc(C[NH])cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.49
PPARA Q07869 9/20 0.49
CYP1A2 P05177 3/20 0.45
CYP3A4 P08684 3/20 0.45
ABCB11 O95342 2/20 0.45
TSHR P16473 2/20 0.45
HTR2A P28223 2/20 0.45
PMP22 Q01453 2/20 0.45
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
CYP2C19 P33261 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP2D6 P10635 1/20 0.40
ELANE P08246 1/20 0.40
TBXAS1 P24557 2/20 0.38
PPARD Q03181 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CYP2C9 P11712 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
SCHEMBL318984 0.85 PPARG (0.68) PPARGPPARACYP1A2CYP3A4ABCB11
SCHEMBL7094948 0.84 PPARA (0.49) PPARGPPARACYP1A2CYP3A4ABCB11
SCHEMBL1549069 0.83 PPARA (0.51) PPARGPPARACYP1A2CYP3A4ABCB11
SCHEMBL25304637 0.81 PPARA (0.46) PPARGPPARACYP1A2CYP3A4ABCB11
SCHEMBL4575316 0.81 PPARA (0.51) PPARGPPARACYP1A2CYP3A4ABCB11
SCHEMBL1586472 0.80 PPARA (0.54) PPARGPPARALMNA
SCHEMBL3484260 0.80 PPARG (0.47) PPARGPPARACYP1A2CYP3A4ABCB11
SCHEMBL1549155 0.80 CYP4F2 (0.47) PPARGPPARACYP1A2CYP3A4ABCB11
SCHEMBL6543925 0.80 PPARA (0.45) PPARGPPARACYP1A2CYP3A4ABCB11
SCHEMBL6081148 0.80 MEN1 (0.49) PPARGPPARACYP1A2CYP3A4ABCB11

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
US-20030032671-A1 Propionic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 2003-02-13 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-20030032671-A1 Propionic acid derivatives PPARD, PPARA, PPARG PPARG 3/4885PPARA 2/4885CYP1A2 2538/4885

“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.