SCHEMBL5565076

SCHEMBL5565076

CC(C)C(c1ccc(NC(=O)N(S)C(=O)c2ccccc2)cc1)n1ccnc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 3/20 0.54
CYP26A1 O43174 11/20 0.50
KDM4E B2RXH2 1/20 0.47
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
KDM4A O75164 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP26B1 Q9NR63 1/20 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
SCHEMBL4047302 0.78 EPHX1 (0.56) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL4046337 0.77 CYP17A1 (0.58) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL4056699 0.76 CYP17A1 (0.57) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL6362302 0.75 CYP17A1 (0.54) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL5565561 0.74 EGFR (0.61) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL6862688 0.74 EGFR (0.61) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL4048704 0.74 CYP17A1 (0.56) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL1262179 0.74 CYP17A1 (0.55) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL1262178 0.74 CYP17A1 (0.55) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2
SCHEMBL4054909 0.73 LMNA (0.54) CYP17A1CYP26A1KDM4ECYP11B1CYP11B2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070105858-A1 RETINOIC ACID MIMETIC ANILIDES MABIRE DOMINIQUE 2007-05-10 US claimed
EP-1037880-B1 RETINOIC ACID MIMETIC ANILIDES JANSSEN PHARMACEUTICA NV (BE) 2004-06-30 EP claimed
EP-1037880-B1 RETINOIC ACID MIMETIC ANILIDES JANSSEN PHARMACEUTICA NV (BE) 2004-06-30 EP 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-20070105858-A1 RETINOIC ACID MIMETIC ANILIDES RXRA, RXRB, RXRG CYP17A1 304/4885CYP26A1 27/4885KDM4E 3791/4885

“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.