SCHEMBL4831385

SCHEMBL4831385

Cc1ccc(N)cc1NC(=O)c1cc(N2CCCN(C)CC2)ccc1N

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
IP6K1 Q92551 1/20 0.45
HDAC3 O15379 2/20 0.45
HDAC8 Q9BY41 1/20 0.45
F10 P00742 11/20 0.45
SIRT6 Q8N6T7 1/20 0.44
WDR5 P61964 1/20 0.43
HDAC2 Q92769 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CSF1R P07333 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C18 P33260 1/20 0.42
CYP2C19 P33261 1/20 0.42
KCNH2 Q12809 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
SCHEMBL4829614 0.96 HDAC3 (0.48) MEN1ALDH1A1GAAMAPK1KMT2A
SCHEMBL1140095 0.85 MAPK14 (0.52) HDAC3HDAC8F10NPC1RAB9A
SCHEMBL4833080 0.80 MAPT (0.48) MEN1ALDH1A1GAAMAPK1KMT2A
SCHEMBL4832961 0.79 SIRT6 (0.61) MEN1ALDH1A1GAAKMT2ASIRT6
SCHEMBL1558664 0.76 MAPT (0.55) ALDH1A1GAAMAPK1KMT2AIP6K1
SCHEMBL4831425 0.75 MAPK1 (0.53) MEN1ALDH1A1GAAMAPK1KMT2A
SCHEMBL1140539 0.75 MAPK11 (0.56) IP6K1
SCHEMBL4824126 0.74 SIRT6 (0.65) MEN1ALDH1A1GAAKMT2ASIRT6
SCHEMBL2460762 0.73 IP6K1 (0.45) GAAMAPK1IP6K1HDAC3HDAC8
SCHEMBL5788418 0.73 SIRT6 (0.55) ALDH1A1GAAMAPK1F10SIRT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275022-A1 Substituted Quinazolones as Anti-Cancer Agents ASTRAZENECA AB (SE) 2008-11-06 US disclosed
US-7442704-B2 Amide derivatives ASTRAZENECA AB (SE) 2008-10-28 US disclosed
US-7332483-B2 3-(5-benzamido-2-chlorophenyl)-7-methoxy-3,4-dihydroquinazolin-4-one;cytokines (tumor necrosis factor and interleukins) inhibitor; antiinflammatory agent, rheumatoid arthritis, osteoarthritis, psoriasis, chronic obstructive pulmonary disease ASTRAZENECA AB (SE) 2008-02-19 US disclosed
EP-1761506-A1 SUBSTITUTED QUINAZOLONES AS ANTI-CANCER AGENTS AstraZeneca AB (SE) 2007-03-14 EP disclosed
US-20060281734-A1 Amide derivatives BROWN DEARG S 2006-12-14 US disclosed
US-7008945-B1 Amide derivatives ASTRAZENECA AB (SE) 2006-03-07 US disclosed
WO-2005123696-A1 SUBSTITUTED QUINAZOLONES AS ANTI-CANCER AGENTS ASTRAZENECA AB (SE) 2005-12-29 WO disclosed
US-20050245551-A1 Amide derivatives ASTRAZENECA AB 2005-11-03 US disclosed
EP-1163237-B1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2004-05-06 EP disclosed
EP-1163237-A1 AMIDE DERIVATIVES AstraZeneca AB (SE) 2001-12-19 EP disclosed
WO-2000055153-A1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2000-09-21 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-20050245551-A1 Amide derivatives IL6, IL6ST, IL1B MEN1 2386/4885ALDH1A1 269/4885GAA 1768/4885
US-20060281734-A1 Amide derivatives IL6, IL6ST, IL1B MEN1 2386/4885ALDH1A1 269/4885GAA 1768/4885
US-20080275022-A1 Substituted Quinazolones as Anti-Cancer Agents BRAF, NRAS, RAF1 MEN1 872/4885ALDH1A1 619/4885GAA 2196/4885

“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.