SCHEMBL3769859

SCHEMBL3769859

CCOc1nc(N)nc2ncc(-c3ccnc(N4CCN(C(=O)OC(C)(C)C)CC4)c3)nc12

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.44
SKP1 P63208 2/20 0.44
SKP2 Q13309 2/20 0.44
MAP4K4 O95819 1/20 0.43
LRRK2 Q5S007 1/20 0.43
RET P07949 2/20 0.42
WNT3A P56704 2/20 0.41
CHRNA7 P36544 1/20 0.40
KIT P10721 1/20 0.39
PIK3CA P42336 1/20 0.39
TBK1 Q9UHD2 2/20 0.39
GBA1 P04062 1/20 0.38
ACHE P22303 1/20 0.38
GPR119 Q8TDV5 3/20 0.38
PGK1 P00558 1/20 0.37
SMARCA2 P51531 1/20 0.37
SMARCA4 P51532 1/20 0.37
PBRM1 Q86U86 1/20 0.37

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
SCHEMBL3766353 0.84 SLC2A1 (0.46)
SCHEMBL3769939 0.84 NOS1 (0.54) CKS1BSKP1SKP2MAP4K4LRRK2
SCHEMBL3762326 0.82 ATR (0.47)
SCHEMBL4112371 0.77 MAP4K4 (0.47) CKS1BSKP1SKP2MAP4K4LRRK2
SCHEMBL3760162 0.77 PIK3CG (0.48) PIK3CA
SCHEMBL3763207 0.75 ROCK2 (0.38) PIK3CA
SCHEMBL3760265 0.75 PIK3CG (0.45) PIK3CA
SCHEMBL1704599 0.75 CKS1B (0.51) CKS1BSKP1SKP2MAP4K4LRRK2
SCHEMBL4102137 0.74 CKS1B (0.54) CKS1BSKP1SKP2MAP4K4LRRK2
SCHEMBL3763004 0.74 NOS1 (0.43) PIK3CA

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-20190152974-A1 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2019-05-23 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
WO-2008009079-A2 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-01-24 WO 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

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 CKS1B 1354/4885SKP1 1958/4885SKP2 277/4885
US-10144736-B2 Substituted pteridines useful for the treatment and prevention of viral infections HCCS, DPYD, HAVCR2 CKS1B 1354/4885SKP1 1958/4885SKP2 277/4885
US-20100305117-A1 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS HCCS, DPYD, HAVCR2 CKS1B 1354/4885SKP1 1958/4885SKP2 277/4885

“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.