SCHEMBL5508557

SCHEMBL5508557

CNc1cc2c(cc1F)C(=O)N(c1ccc(NC(=O)NS(=O)(=O)c3ccc(C)s3)nc1)CO2

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.39
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FBP1 P09467 1/20 0.31
F10 P00742 2/20 0.30

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
SCHEMBL5511683 0.92 P2RY12 (0.48) P2RY12ALDH1A1SMN1; SMN2FBP1F10
SCHEMBL5512246 0.91 P2RY12 (0.38) P2RY12F10
SCHEMBL5547100 0.88 P2RY12 (0.48) P2RY12F10
SCHEMBL14522015 0.86 P2RY12 (0.33) P2RY12ALDH1A1SMN1; SMN2FBP1
SCHEMBL14522018 0.84 P2RY12 (0.41) P2RY12ALDH1A1SMN1; SMN2FBP1
SCHEMBL14544550 0.83 P2RY12 (0.32) P2RY12ALDH1A1SMN1; SMN2F10
SCHEMBL14522019 0.83 P2RY12 (0.46) P2RY12FBP1F10
SCHEMBL14522009 0.83 P2RY12 (0.47) P2RY12FBP1F10
SCHEMBL5513366 0.82 P2RY12 (0.47) P2RY12ALDH1A1SMN1; SMN2FBP1F10
SCHEMBL14522023 0.80 P2RY12 (0.46) P2RY12SMN1; SMN2F10

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-7205296-B2 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2007-04-17 US disclosed
US-7205296-B2 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2007-04-17 US disclosed
US-7205296-B2 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2007-04-17 US disclosed
US-20060069093-A1 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2006-03-30 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-20060069093-A1 Substituted 2H-1,3-benzoxazin-4(3H)-ones TBXAS1, TBXA2R, SERPINC1 P2RY12 677/4885ALDH1A1 704/4885SMN1; SMN2 933/4885

“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.