SCHEMBL5835348

SCHEMBL5835348

COC(=O)CCc1ccc(O)c(C(C)(C)Cn2nc3ccc(Cl)cc3n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
EGFR P00533 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
PTPN1 P18031 1/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
P2RX3 P56373 2/20 0.35
ALOX5 P09917 1/20 0.34
OR51E2 Q9H255 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
CCR9 P51686 2/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
P2RY12 Q9H244 1/20 0.34
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
APP P05067 1/20 0.33

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
SCHEMBL7955396 0.87 FFAR4 (0.38) KDM4EPTPN1APP
SCHEMBL9580856 0.79 EGFR (0.43) KDM4EEGFRCYP11B1CYP11B2MAPT
SCHEMBL135249 0.77 FFAR1 (0.40) TP53MDM2
SCHEMBL3416177 0.76 APP (0.43) KDM4EALDH1A1APP
SCHEMBL78795 0.75 GAA (0.42) KDM4EEGFRCYP11B1CYP11B2ALDH1A1
SCHEMBL29664175 0.75 GAA (0.42) KDM4EEGFRCYP11B1CYP11B2ALDH1A1
SCHEMBL27381689 0.75 ALOX5 (0.46) PTPN1ALDH1A1ALOX5OR51E2APP
SCHEMBL490455 0.73 GAA (0.49) PTPN1ALDH1A1LMNAALOX5OR51E2
SCHEMBL1896797 0.73 MAOB (0.42) KDM4EEGFRCYP11B1CYP11B2ALDH1A1
SCHEMBL6862492 0.72 KDM4E (0.38) KDM4EEGFRCYP11B1CYP11B2MAPT

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-7074906-B2 Organic solvent-free process for the preparation of 2-(2-nitrophenylazo)phenols CIBA SPECIALTY CHEMICALS CORPORATION (US) 2006-07-11 US disclosed
US-20050053562-A1 Organic solvent-free process for the preparation of 2-(2-nitrophenylazo)phenols CIBA SPECIALTY CHEMICALS CORP. 2005-03-10 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-20050053562-A1 Organic solvent-free process for the preparation of 2-(2-nitrophenylazo)phenols HPD, CYP8B1, CYP3A4 KDM4E 901/4885EGFR 4459/4885CYP11B1 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.