SCHEMBL4107705

SCHEMBL4107705

Cc1cc(N)ccc1-c1ccc2nc(N)nc(Cc3ccccc3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TLR8 Q9NR97 4/20 0.39
TLR7 Q9NYK1 4/20 0.39
DHFR P00374 11/20 0.36
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34

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
SCHEMBL4102045 0.91 MPO (0.41) MPOKDM4EGAAMAPTPKM
SCHEMBL4103486 0.84 MPO (0.41) MPOKDM4EGAAMAPTTLR8
SCHEMBL4108361 0.82 DHFR (0.36) KDM4EGAAMAPTTLR8TLR7
SCHEMBL4097614 0.81 MPO (0.41) MPOKDM4EGAAMAPTTLR8
SCHEMBL4102200 0.81 MPO (0.43) MPOKDM4EGAAMAPTPKM
SCHEMBL4103653 0.80 TLR9 (0.44) KDM4EGAAMAPTDHFR
SCHEMBL4097223 0.80 MPO (0.40) MPOTLR8TLR7DHFR
SCHEMBL4113317 0.79 ADORA2A (0.43) MPOTLR8TLR7DHFR
SCHEMBL4102866 0.79 MPO (0.43) MPOTLR8TLR7DHFR
SCHEMBL4110147 0.78 HSP90AA1 (0.39) MPOKDM4EGAAMAPTTLR8

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-20090253696-A1 SUBSTITUTED PYRIDO(3,2-D) PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. 2009-10-08 US 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 MPO 2952/4885KDM4E 2414/4885GAA 2663/4885

“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.