SCHEMBL4701840

SCHEMBL4701840

CCOC(=O)C(C)(C)Oc1ccc(-c2ccccn2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.57
CYP1A2 P05177 2/20 0.57
ABCB11 O95342 1/20 0.57
CYP3A4 P08684 1/20 0.57
TSHR P16473 1/20 0.57
HTR2A P28223 1/20 0.57
PMP22 Q01453 1/20 0.57
CYP2D6 P10635 1/20 0.51
CYP19A1 P11511 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
FBP1 P09467 3/20 0.47
PPARG P37231 3/20 0.45
LMNA P02545 1/20 0.43
TRPV1 Q8NER1 1/20 0.43
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
DCTPP1 Q9H773 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL4705026 0.82 PPARG (0.53) PPARACYP1A2CYP3A4TSHRCYP2D6
SCHEMBL31357593 0.80 PPARA (0.54) PPARACYP1A2ABCB11CYP3A4TSHR
SCHEMBL23582156 0.80 PPARA (0.54) PPARACYP1A2ABCB11CYP3A4TSHR
SCHEMBL23582372 0.79 PPARA (0.53) PPARACYP1A2ABCB11CYP3A4TSHR
SCHEMBL2824491 0.79 PPARA (0.71) PPARACYP1A2ABCB11CYP3A4TSHR
SCHEMBL3485018 0.78 PPARA (0.69) PPARACYP1A2ABCB11CYP3A4TSHR
SCHEMBL11449451 0.77 CXCR4 (0.52) PPARACYP1A2ABCB11CYP3A4TSHR
SCHEMBL11261797 0.77 PPARA (0.43) PPARACYP1A2ABCB11CYP3A4TSHR
SCHEMBL10305325 0.76 PPARA (0.50) PPARACYP1A2ABCB11CYP3A4TSHR
SCHEMBL11766162 0.76 KDM4E (0.48) PPARACYP1A2ABCB11CYP3A4TSHR

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
EP-1758582-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-09 EP disclosed
EP-1758582-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-03-07 EP disclosed
US-20060009471-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-01-12 US disclosed
WO-2006002349-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-01-05 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-20060009471-A1 Amido compounds and their use as pharmaceuticals HSD11B1, CYP11B1, HSD11B2 PPARA 340/4885CYP1A2 174/4885ABCB11 150/4885

“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.