SCHEMBL4358170

SCHEMBL4358170

Clc1ccc(-c2ccc3ncnc(NC4CCCC4)c3c2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.76
CYP1A2 P05177 9/20 0.64
CLK4 Q9HAZ1 8/20 0.64
USP2 O75604 7/20 0.64
CYP3A4 P08684 7/20 0.64
LMNA P02545 5/20 0.64
HSD17B10 Q99714 4/20 0.64
MAPK1 P28482 3/20 0.64
CD38 P28907 4/20 0.63
CYP2D6 P10635 6/20 0.60
CYP2C19 P33261 6/20 0.60
ALDH1A1 P00352 3/20 0.60
ALOX15 P16050 2/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
IRAK4 Q9NWZ3 3/20 0.59
PDPK1 O15530 1/20 0.57
RPS6KB1 P23443 1/20 0.57
TSHR P16473 4/20 0.57
HPGD P15428 1/20 0.54

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
SCHEMBL4351313 0.99 MAP4K4 (0.74) MAP4K4CYP1A2CLK4USP2CYP3A4
SCHEMBL4353155 0.95 MAP4K4 (0.79) MAP4K4CYP1A2CLK4USP2CYP3A4
Hydrochloric Acid SCHEMBL8376734 0.88 MAP4K4 (0.69) MAP4K4CYP1A2CLK4USP2CYP3A4
SCHEMBL4363836 0.87 MAP4K4 (0.65) MAP4K4CYP1A2CLK4USP2CYP3A4
SCHEMBL15587775 0.86 MAP4K4 (1.00) MAP4K4CYP1A2CLK4USP2CYP3A4
SCHEMBL4358072 0.86 CD38 (0.64) MAP4K4CYP1A2CLK4USP2CYP3A4
SCHEMBL17665939 0.86 MAP4K4 (0.70) MAP4K4CYP1A2CLK4USP2CYP3A4
SCHEMBL15587249 0.83 MAP4K4 (1.00) MAP4K4CYP1A2CLK4USP2CYP3A4
SCHEMBL21318842 0.82 IRAK4 (0.73) MAP4K4CYP1A2CLK4USP2CYP3A4
SCHEMBL17665940 0.81 IRAK4 (0.70) MAP4K4CYP1A2CLK4USP2CYP3A4

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 MAP4K4 1801/4885CYP1A2 1131/4885CLK4 957/4885
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR4A1 MAP4K4 1801/4885CYP1A2 1131/4885CLK4 957/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 MAP4K4 1921/4885CYP1A2 1129/4885CLK4 960/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 MAP4K4 1837/4885CYP1A2 1078/4885CLK4 1192/4885
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR5A2 MAP4K4 1837/4885CYP1A2 1078/4885CLK4 1192/4885

“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.