SCHEMBL4252286

SCHEMBL4252286

CNC(=O)c1ncccc1Oc1ccc(N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
APAF1 O14727 1/20 0.45
KMT2A Q03164 1/20 0.45
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC3 O15379 2/20 0.40
BRAF P15056 2/20 0.40
HDAC4 P56524 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC7 Q8WUI4 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC10 Q969S8 2/20 0.40
HDAC11 Q96DB2 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HDAC9 Q9UKV0 2/20 0.40
HDAC5 Q9UQL6 2/20 0.40
GRM4 Q14833 1/20 0.39

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
SCHEMBL29614703 1.00 MEN1 (0.45) MEN1APAF1KMT2AHPGDTSHR
SCHEMBL6049774 0.84 ALDH1A1 (0.46) MEN1KMT2AHTTSMN1; SMN2HDAC3
SCHEMBL28026579 0.82 GCK (0.44) HDAC3BRAFHDAC4HDAC1HDAC7
SCHEMBL30438344 0.82 GCK (0.44) HDAC3BRAFHDAC4HDAC1HDAC7
SCHEMBL4265602 0.78 NAMPT (0.48) MEN1KMT2AHPGDSMN1; SMN2ALDH1A1
SCHEMBL5094162 0.78 ALDH1A1 (0.60) KMT2AALDH1A1
SCHEMBL29626741 0.77 CTSA (0.51) MEN1KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL15524525 0.77 CTSA (0.51) MEN1KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL30448150 0.76 HTT (0.39) HPGDTSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL28408407 0.76 KDM4E (0.39) MEN1KMT2ASMN1; SMN2HDAC3BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108602837-A With the compound and its salt for inhibiting platelet aggregation effect and include its composition for preventing or treating thrombotic diseases 新丰制药株式会社 2018-09-28 CN disclosed
US-20090124633-A1 N-OXIDES OF HETEROCYCLIC SUBSTITUTED BISARYLUREAS FOR TREATING KINASE-MEDIATED DISEASES MERCK PATENT GESELLSCHAFT (DE) 2009-05-14 US disclosed
EP-2004631-A1 N-OXIDES OF HETEROCYCLIC SUBSTITUTED BISARYLUREAS FOR TREATING KINASE-MEDIATED DISEASES Merck Patent GmbH (DE) 2008-12-24 EP disclosed
WO-2007115670-A1 N-OXIDES OF HETEROCYCLIC SUBSTITUTED BISARYLUREAS FOR TREATING KINASE-MEDIATED DISEASES MERCK PATENT GMBH (DE) 2007-10-18 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 (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-20090124633-A1 N-OXIDES OF HETEROCYCLIC SUBSTITUTED BISARYLUREAS FOR TREATING KINASE-MEDIATED DISEASES ABL1, NME2, MAP3K1 MEN1 1544/4885APAF1 3594/4885KMT2A 776/4885

“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.