SCHEMBL4359538

SCHEMBL4359538

CCOc1ccc(-c2ccc3ncnc(NCCC(C)C)c3c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
POLB P06746 1/20 0.53
ALDH1A1 P00352 10/20 0.52
CLK4 Q9HAZ1 9/20 0.52
CYP1A2 P05177 9/20 0.52
CYP3A4 P08684 8/20 0.52
CYP2D6 P10635 6/20 0.52
CYP2C19 P33261 6/20 0.52
USP2 O75604 5/20 0.52
MAPK1 P28482 2/20 0.52
RAF1 P04049 1/20 0.52
BRAF P15056 1/20 0.52
HSD17B10 Q99714 9/20 0.51
MAP4K4 O95819 3/20 0.50
CLK1 P49759 1/20 0.49
DYRK1A Q13627 1/20 0.48
CASP1 P29466 1/20 0.48
TSHR P16473 4/20 0.47
LMNA P02545 3/20 0.47

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
SCHEMBL4357101 0.90 CLK4 (0.62) MEN1KMT2APOLBALDH1A1CLK4
SCHEMBL4351893 0.88 CLK4 (0.52) MEN1KMT2AALDH1A1CLK4CYP1A2
SCHEMBL18041188 0.87 CLK4 (0.48) MEN1KMT2AALDH1A1CLK4CYP1A2
SCHEMBL4351224 0.86 CYP1A2 (0.48) MEN1KMT2APOLBALDH1A1CLK4
SCHEMBL4362061 0.86 CYP1A2 (0.54) MEN1KMT2AALDH1A1CLK4CYP1A2
SCHEMBL4355900 0.85 MAP4K4 (0.60) MEN1KMT2AALDH1A1CLK4CYP1A2
SCHEMBL4355483 0.85 CYP1A2 (0.50) MEN1KMT2APOLBALDH1A1CLK4
SCHEMBL4353347 0.85 MEN1 (0.49) MEN1KMT2APOLBALDH1A1CLK4
SCHEMBL4359620 0.85 HTT (0.51) MEN1KMT2AALDH1A1CLK4CYP1A2
SCHEMBL4355612 0.85 CYP1A2 (0.49) MEN1KMT2AALDH1A1CLK4CYP1A2

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 8 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
WO-2008009078-A2 4,6-DL- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING 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 (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 MEN1 2330/4885KMT2A 2369/4885POLB 2474/4885
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR4A1 MEN1 2330/4885KMT2A 2369/4885POLB 2474/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 MEN1 2182/4885KMT2A 2367/4885POLB 2478/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 MEN1 2194/4885KMT2A 2394/4885POLB 2282/4885
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR5A2 MEN1 2194/4885KMT2A 2394/4885POLB 2282/4885

“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.