SCHEMBL4585294

SCHEMBL4585294

[NH]Cc1ccc(S(N)(=O)=O)cc1F

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 18/20 0.61
CA1 P00915 11/20 0.56
CA9 Q16790 5/20 0.56
CA12 O43570 2/20 0.56
CA4 P22748 1/20 0.56
CA6 P23280 1/20 0.56
CA5A P35218 1/20 0.56
CA7 P43166 1/20 0.56
CA14 Q9ULX7 1/20 0.56
CA5B Q9Y2D0 1/20 0.56
EPHX2 P34913 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
KIF11 P52732 1/20 0.42

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
SCHEMBL4585303 0.83 CA2 (0.63) CA2CA1CA9CA12CA4
SCHEMBL19938066 0.83 CA2 (0.63) CA2CA1CA9CA12CA4
SCHEMBL27350533 0.81 CA2 (0.61) CA2CA1CA9CA12CA4
SCHEMBL31451688 0.81 CA2 (0.61) CA2CA1CA9CA12CA4
SCHEMBL3102634 0.81 CA2 (0.71) CA2CA1CA9CA12CA4
SCHEMBL24517597 0.81 CA2 (0.61) CA2CA1CA9CA12CA4
SCHEMBL22792700 0.79 CA2 (0.67) CA2CA1CA9CA12CA4
SCHEMBL9969429 0.77 CA2 (0.56) CA2CA1CA9CA12CA4
SCHEMBL20692332 0.77 CA2 (0.56) CA2CA1CA9CA12CA4
SCHEMBL14270191 0.77 CA2 (0.52) CA2CA1CA9CA12CA4

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-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US claimed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO claimed
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US disclosed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US disclosed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO 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-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, DPYD, PNP CA2 4444/4885CA1 4802/4885CA9 4708/4885

“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.