SCHEMBL3769869

SCHEMBL3769869

CCOc1nc(N)nc2ncc(-c3ccc(C(=O)NC4CC4)cc3)nc12

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATR Q13535 4/20 0.48
USP7 Q93009 1/20 0.43
ACVR2A P27037 1/20 0.42
TGFBR2 P37173 1/20 0.42
ACVR1 Q04771 2/20 0.42
CHEK2 O96017 1/20 0.42
MET P08581 1/20 0.42
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
NOS1 P29475 1/20 0.41
TTK P33981 5/20 0.41
FYN P06241 1/20 0.41
PIK3CG P48736 1/20 0.41
MAPK14 Q16539 1/20 0.41

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
SCHEMBL3765175 0.90 ATR (0.49) ATRMEN1RAB9AKMT2ANOS1
SCHEMBL3764228 0.87 PRKDC (0.46) ATRUSP7NOS1PIK3CG
SCHEMBL20985861 0.86 PIK3CG (0.44) ACVR1NOS1PIK3CG
SCHEMBL3769952 0.83 NOS1 (0.47) RAB9ANOS1PIK3CG
SCHEMBL4452145 0.83 PIK3CG (0.47) ATRNOS1PIK3CG
SCHEMBL3755444 0.83 PIK3CG (0.47) ATRNOS1PIK3CG
SCHEMBL3752734 0.83 NOS1 (0.49) RAB9ANOS1PIK3CG
SCHEMBL3763567 0.82 NOS1 (0.48) RAB9ANOS1PIK3CG
SCHEMBL823680 0.82 MKNK1 (0.49) ACVR2ATGFBR2ACVR1MEN1RAB9A
SCHEMBL3755372 0.81 NPC1 (0.47) RAB9ANOS1PIK3CG

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-10144736-B2 Substituted pteridines useful for the treatment and prevention of viral infections GILEAD SCIENCES, INC. (US) 2018-12-04 US claimed
US-20100305117-A1 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2010-12-02 US claimed
US-20190152974-A1 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2019-05-23 US disclosed
US-10144736-B2 Substituted pteridines useful for the treatment and prevention of viral infections GILEAD SCIENCES, INC. (US) 2018-12-04 US disclosed
US-20100305117-A1 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2010-12-02 US disclosed
WO-2008009079-A2 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF 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 (3 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-20190152974-A1 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS HCCS, DPYD, HAVCR2 ATR 2767/4885USP7 3998/4885ACVR2A 3129/4885
US-10144736-B2 Substituted pteridines useful for the treatment and prevention of viral infections HCCS, DPYD, HAVCR2 ATR 2767/4885USP7 3998/4885ACVR2A 3129/4885
US-20100305117-A1 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS HCCS, DPYD, HAVCR2 ATR 2767/4885USP7 3998/4885ACVR2A 3129/4885

“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.