SCHEMBL4356845

SCHEMBL4356845

CCCCNc1ncnc2ccc(-c3ccc(OC)c(OC)c3)cc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 9/20 0.62
ALDH1A1 P00352 9/20 0.57
CYP1A2 P05177 9/20 0.57
CYP3A4 P08684 8/20 0.57
CYP2D6 P10635 8/20 0.57
HSD17B10 Q99714 8/20 0.57
CYP2C19 P33261 7/20 0.57
USP2 O75604 5/20 0.57
TSHR P16473 5/20 0.56
LMNA P02545 5/20 0.56
MAPK1 P28482 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
STAT3 P40763 1/20 0.56
APP P05067 1/20 0.54
RAF1 P04049 4/20 0.54
BRAF P15056 4/20 0.54
CYP2C9 P11712 3/20 0.53
THRB P10828 1/20 0.53

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
SCHEMBL4354805 0.93 CLK4 (0.64) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL4355619 0.85 CLK4 (0.61) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL4353570 0.81 CLK1 (0.56) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL4351404 0.81 MAP4K4 (0.60) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL4362251 0.81 APP (0.55) ALDH1A1CYP1A2CYP2D6APP
SCHEMBL4355479 0.80 CLK4 (0.60) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL1675360 0.79 CLK4 (0.57) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL3331678 0.79 PIK3CD (0.55) CLK4RAF1BRAF
SCHEMBL4359385 0.77 HTT (0.83) ALDH1A1TSHRLMNAMAPK1SMN1; SMN2
SCHEMBL23762377 0.77 EGFR (0.63) MAPK1SMN1; SMN2MEN1KMT2ASTAT3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2009-11-19 US claimed
US-12049461-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections GILEAD SCIENCES, INC. (US) 2024-07-30 US disclosed
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. 2021-09-09 US disclosed
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections GILEAD SCIENCES, INC. (US) 2021-01-05 US disclosed
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. 2016-09-08 US disclosed
US-9259426-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections GILEAD SCIENCES, INC. (US) 2016-02-16 US disclosed
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2009-11-19 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 (5 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-12049461-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR4A1 CLK4 957/4885ALDH1A1 2743/4885CYP1A2 1131/4885
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR4A1 CLK4 957/4885ALDH1A1 2743/4885CYP1A2 1131/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 CLK4 960/4885ALDH1A1 2942/4885CYP1A2 1129/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 CLK4 1192/4885ALDH1A1 3119/4885CYP1A2 1078/4885
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR5A2 CLK4 1192/4885ALDH1A1 3119/4885CYP1A2 1078/4885

“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.