SCHEMBL4108367

SCHEMBL4108367

Cn1ccc2cc(-c3ccc4nc(N)nc(Cc5ccccc5)c4n3)ccc21

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.49
HSD11B1 P28845 1/20 0.42
DHFR P00374 1/20 0.39
TRPV3 Q8NET8 1/20 0.39
MAOB P27338 1/20 0.38
MPO P05164 1/20 0.38
CLK4 Q9HAZ1 3/20 0.38
MAP4K4 O95819 1/20 0.37
GRK5 P34947 1/20 0.37
SLC2A1 P11166 2/20 0.36
PRKCI P41743 1/20 0.36
LRRK2 Q5S007 1/20 0.36
APP P05067 1/20 0.36

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
SCHEMBL4107065 0.84 DHFR (0.41) FAAHHSD11B1DHFRTRPV3MAOB
SCHEMBL4113446 0.83 HSD11B1 (0.48) FAAHHSD11B1DHFRMAOBMAP4K4
SCHEMBL4107221 0.82 CYP1A1 (0.49) DHFRMPOMAP4K4
SCHEMBL4102747 0.81 PIK3CD (0.42) FAAH
SCHEMBL4113790 0.79 MPO (0.48) DHFRMPOMAP4K4SLC2A1
SCHEMBL4109873 0.77 MPO (0.41) MPOCLK4
SCHEMBL4102085 0.77 NPC1 (0.44) DHFRMPOMAP4K4
SCHEMBL4103501 0.77 MPO (0.43) DHFRMPOMAP4K4APP
SCHEMBL4114223 0.77 NOS1 (0.43) DHFRMPOMAP4K4
SCHEMBL4105813 0.76 MPO (0.45) DHFRMPOMAP4K4APP

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-20090253696-A1 SUBSTITUTED PYRIDO(3,2-D) PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. 2009-10-08 US claimed
WO-2008009076-A2 SUBSTITUTED PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-01-24 WO claimed
US-8338435-B2 Substituted pyrido(3,2-D) pyrimidines and pharmaceutical compositions for treating viral infections GILEAD SCIENCES, INC. (US) 2012-12-25 US disclosed
US-20090253696-A1 SUBSTITUTED PYRIDO(3,2-D) PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. 2009-10-08 US disclosed
WO-2008009076-A2 SUBSTITUTED PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-01-24 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-20090253696-A1 SUBSTITUTED PYRIDO(3,2-D) PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING VIRAL INFECTIONS PNPO, PNP, DPYD FAAH 3727/4885HSD11B1 2413/4885DHFR 145/4885

“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.