SCHEMBL1858845

SCHEMBL1858845

COc1ccc(CN2Cc3cc(Cl)ccc3N(Cc3ccccc3)C2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
SIGMAR1 Q99720 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CASP3 P42574 2/20 0.44
EP300 Q09472 1/20 0.44
APAF1 O14727 1/20 0.44
GAA P10253 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
SCN9A Q15858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43

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
SCHEMBL8255367 0.78 CASP3 (0.52) CMA1HDAC6TP53MAPTMEN1
SCHEMBL29173729 0.76 HDAC1 (0.63) CMA1HDAC6MAPTLMNAMEN1
SCHEMBL3408919 0.76 CASP3 (0.52) CMA1HDAC6TP53MAPTMEN1
SCHEMBL14991264 0.75 GAA (0.47) CMA1TP53MAPTLMNAHTT
SCHEMBL11187851 0.75 TSHR (0.41) CMA1TP53MAPTLMNAHTT
SCHEMBL6706100 0.73 MMP13 (0.42) MAPTLMNAHTTNPSR1SIGMAR1
SCHEMBL3944389 0.72 HDAC6 (0.46) CMA1HDAC6MAPTLMNAHTT
SCHEMBL21310500 0.72 CHRM5 (0.44) CMA1TP53MAPTMEN1KMT2A
SCHEMBL578360 0.71 MEN1 (0.57) CMA1MAPTMEN1KMT2ACASP3
SCHEMBL30068092 0.71 MEN1 (0.57) CMA1MAPTMEN1KMT2ACASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049503-B1 QUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES AS P38 KINASE INHIBITORS AMGEN INC (US) 2012-12-19 EP disclosed
US-7935709-B2 2-quinazolinone compounds and methods of use AMGEN INC. (US) 2011-05-03 US disclosed
US-20080032973-A1 2-Quinazolinone compounds and methods of use AMGEN INC. (US) 2008-02-07 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 (1 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-20080032973-A1 2-Quinazolinone compounds and methods of use MAP3K1, MAP3K2, MAP3K7 CMA1 628/4885HDAC6 1955/4885TP53 2258/4885

“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.