SCHEMBL4809989

SCHEMBL4809989

Fc1ccc2c(c1)Nc1ccccc1CO2

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 16/20 0.47
CYP3A4 P08684 2/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2C9 P11712 2/20 0.46
PGR P06401 5/20 0.41
NOX1 Q9Y5S8 1/20 0.40
NR3C1 P04150 2/20 0.40
NOTUM Q6P988 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
SCHEMBL4810558 0.89 ALOX5 (0.41) NR3C2CYP3A4CYP2D6CYP2C9PGR
SCHEMBL4806003 0.87 NR3C2 (0.44) NR3C2CYP3A4CYP2D6CYP2C9PGR
SCHEMBL4809130 0.85 NOX1 (0.42) NR3C2CYP3A4CYP2D6CYP2C9PGR
SCHEMBL4809585 0.80 BCHE (0.44) PGRNOX1NOTUM
SCHEMBL18173701 0.80 MMP12 (0.61)
SCHEMBL2008333 0.80 ALOX5 (0.54)
SCHEMBL22748137 0.80 CYBB (0.48) NOX1
SCHEMBL10510154 0.77 NR3C2 (0.48) NR3C2CYP3A4CYP2D6CYP2C9PGR
SCHEMBL707058 0.76 MMP12 (0.65) NR3C2PGRNR3C1
SCHEMBL766354 0.75 ALOX5 (0.65) NOX1

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 NR3C2 431/4885CYP3A4 1/4885CYP2D6 11/4885

“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.