SCHEMBL3770164

SCHEMBL3770164

CCOc1nc(N)nc2ncc(-c3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3)nc12

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.54
NOS1 P29475 1/20 0.47
ACR P10323 1/20 0.46
LMNA P02545 3/20 0.45
MAPK1 P28482 1/20 0.45
NPY5R Q15761 3/20 0.45
PIK3CB P42338 1/20 0.44
IKBKB O14920 1/20 0.44
CHUK O15111 1/20 0.44
ALDH1A1 P00352 2/20 0.43
RECQL P46063 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SREBF2 Q12772 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL3766597 0.88 ATR (0.46) NOS1LMNAMAPK1SREBF2
SCHEMBL3755577 0.85 NOS1 (0.61) NOS1PIK3CB
SCHEMBL3760769 0.83 NOS1 (0.47) NOS1
SCHEMBL3757246 0.83 LMNA (0.47) MAPTLMNAALDH1A1SMN1; SMN2HSD17B10
SCHEMBL3760805 0.82 NOS1 (0.47) NOS1
SCHEMBL3765843 0.80 NOS1 (0.48) NOS1PIK3CB
SCHEMBL3761237 0.79 PIK3CG (0.45) NOS1PIK3CB
SCHEMBL3761399 0.78 PIK3CA (0.46) MAPTNOS1LMNAALDH1A1KDM4E
SCHEMBL3755599 0.78 NOS1 (0.52) MAPTNOS1PIK3CBKDM4E
SCHEMBL3760070 0.77 NOS1 (0.61) MAPTNOS1MAPK1NPY5RALDH1A1

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
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 MAPT 4683/4885NOS1 2154/4885ACR 4061/4885
US-10144736-B2 Substituted pteridines useful for the treatment and prevention of viral infections HCCS, DPYD, HAVCR2 MAPT 4683/4885NOS1 2154/4885ACR 4061/4885
US-20100305117-A1 SUBSTITUTED PTERIDINES USEFUL FOR THE TREATMENT AND PREVENTION OF VIRAL INFECTIONS HCCS, DPYD, HAVCR2 MAPT 4683/4885NOS1 2154/4885ACR 4061/4885

“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.