SCHEMBL4809130

SCHEMBL4809130

Fc1ccc2c(c1)COc1ccccc1N2

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.42
ALOX5 P09917 1/20 0.41
NR3C2 P08235 11/20 0.41
HTR5A P47898 2/20 0.41
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 0.40
HTR2B P41595 1/20 0.40
KMT2A Q03164 1/20 0.37
PGR P06401 2/20 0.37
AR P10275 1/20 0.37
NOTUM Q6P988 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
SCHEMBL4806003 0.89 NR3C2 (0.44) NOX1ALOX5NR3C2HTR5ACYP3A4
SCHEMBL4810558 0.87 ALOX5 (0.41) NOX1ALOX5NR3C2HTR5ACYP3A4
SCHEMBL4809989 0.85 NR3C2 (0.47) NOX1NR3C2CYP3A4CYP2D6CYP2C9
SCHEMBL2008333 0.82 ALOX5 (0.54) ALOX5HTR5AKMT2A
SCHEMBL4807696 0.81 AHR (0.44) NOX1ALOX5HTR5AHTR2BKMT2A
SCHEMBL14279327 0.78 HTR5A (0.39) NR3C2HTR5AHTR2B
SCHEMBL17079539 0.78 MAPT (0.53) NOX1HTR5AKMT2A
SCHEMBL31261247 0.75 CYP11B1 (0.51) NR3C2HTR5AKMT2APGR
SCHEMBL17079963 0.74 ALOX5 (0.65) NOX1ALOX5HTR2BKMT2A
SCHEMBL14279325 0.72 AHR (0.41) NOX1ALOX5HTR5ACYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7320973-B2 Dihydrodiaryloxazepine derivative and pharmaceutical composition containing the same AJINOMOTO CO., INC. (JP) 2008-01-22 US disclosed
US-7320973-B2 Dihydrodiaryloxazepine derivative and pharmaceutical composition containing the same AJINOMOTO CO., INC. (JP) 2008-01-22 US disclosed
US-7320973-B2 Dihydrodiaryloxazepine derivative and pharmaceutical composition containing the same AJINOMOTO CO., INC. (JP) 2008-01-22 US disclosed
US-20040110742-A1 Dihydrodiaryloxazepine derivative and pharmaceutical composition containing the same AJINOMOTO CO., INC. (JP) 2004-06-10 US disclosed
EP-1403258-A1 DIHYDRODIARYLOXAZEPINE DERIVATIVE AND MEDICINAL COMPOSITION CONTAINING THE DERIVATIVE Ajinomoto Co., Inc. (JP) 2004-03-31 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-20040110742-A1 Dihydrodiaryloxazepine derivative and pharmaceutical composition containing the same CYP3A4, PPARD, CYP4B1 NOX1 3093/4885ALOX5 764/4885NR3C2 431/4885

“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.