SCHEMBL6984099

SCHEMBL6984099

COc1ccc2c(c1)NC(c1ccccc1)CO2

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 5/20 0.52
FFAR1 O14842 1/20 0.48
ABCB1 P08183 1/20 0.44
AR P10275 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44
MAOB P27338 1/20 0.41
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
HSP90AA1 P07900 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
SCHEMBL11341890 0.81 CYP19A1 (0.49) CYP19A1ARMAOBALDH1A1MAPT
SCHEMBL11862421 0.78 CYP19A1 (0.42) CYP19A1ARDRD2DRD3MAPT
SCHEMBL29903416 0.77 MEN1 (0.49) CYP19A1ARALDH1A1MAPTNPC1
SCHEMBL6436184 0.77 MEN1 (0.49) CYP19A1ARALDH1A1MAPTNPC1
SCHEMBL5451243 0.77 MEN1 (0.49) CYP19A1ARALDH1A1MAPTNPC1
SCHEMBL19423617 0.75 FFAR1 (0.63) CYP19A1FFAR1MAPTHSP90AA1
SCHEMBL11327485 0.74 MAOB (0.44) CYP19A1FFAR1MAOBALDH1A1MAPT
SCHEMBL31357823 0.74 ABCG2 (0.49) CYP19A1ABCB1ARABCG2MAOB
SCHEMBL11561473 0.73 HTR1A (0.39) CYP19A1DRD2DRD3MAPT
SCHEMBL20439366 0.73 MAOB (0.45) CYP19A1FFAR1MAOBDRD2DRD3

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
US-6620809-B2 Useful in treating or in preventing melatoninergic disorders LES LABORATOIRES SERVIER (FR) 2003-09-16 US disclosed
EP-1106608-B1 Substituted (dihydro)benzoxazine and (dihydro)benzothiazine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-03-05 EP disclosed
US-20010003747-A1 New substituted (dihydro)benzoxazine and (dihydro)benzothiazine compounds LES LABORATOIRES SERVIER (FR) 2001-06-14 US disclosed
EP-1106608-A1 Substituted (dihydro)benzoxazine and (dihydro)benzothiazine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-06-13 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-20010003747-A1 New substituted (dihydro)benzoxazine and (dihydro)benzothiazine compounds MTNR1A, MTNR1B, SQOR CYP19A1 277/4885FFAR1 1177/4885ABCB1 2686/4885

“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.