SCHEMBL5113153

SCHEMBL5113153

NS(=O)(=O)c1ccc(CNc2nc(NC3CC3)c3nc(-c4ccc(F)c(NS(=O)(=O)C5CC5)c4)ccc3n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.38
AXL P30530 1/20 0.37
TYRO3 Q06418 1/20 0.37
MERTK Q12866 1/20 0.37
NPR1 P16066 1/20 0.36
CA1 P00915 9/20 0.36
CA2 P00918 9/20 0.36
CA9 Q16790 9/20 0.36
GHSR Q92847 1/20 0.36
SYK P43405 1/20 0.35
CA12 O43570 1/20 0.35
CA14 Q9ULX7 1/20 0.35
PTGS1 P23219 1/20 0.35
CDK4 P11802 1/20 0.34
CDK2 P24941 1/20 0.34
VCP P55072 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
MAP4K4 O95819 1/20 0.33

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
SCHEMBL5121941 0.89 PTGS2 (0.40) PTGS2CA1CA2CA9CA12
SCHEMBL14131400 0.89 CA1 (0.36) PTGS2CA1CA2CA9CA12
SCHEMBL5113160 0.86 CA1 (0.36) PTGS2AXLTYRO3MERTKNPR1
SCHEMBL14131693 0.85 CA1 (0.43) PTGS2CA1CA2CA9CA12
SCHEMBL5107326 0.84 PTGS2 (0.43) PTGS2AXLTYRO3MERTKNPR1
SCHEMBL5111068 0.82 CA1 (0.46) PTGS2AXLTYRO3MERTKCA1
SCHEMBL5114632 0.80 PTGS2 (0.42) PTGS2CA1CA2CA9CA12
SCHEMBL5111065 0.79 SYK (0.44) PTGS2AXLTYRO3MERTKCA1
SCHEMBL5112869 0.78 AXL (0.45) PTGS2AXLTYRO3MERTKCA1
SCHEMBL3337816 0.76 CA1 (0.45) PTGS2CA1CA2CA9CA12

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 6 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 disclosed
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US disclosed
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
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US disclosed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 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-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, DPYD, PNP PTGS2 1073/4885AXL 682/4885TYRO3 538/4885

“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.