SCHEMBL4265602

SCHEMBL4265602

CNC(=O)c1ncccc1Oc1ccc(NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.48
METAP1 P53582 1/20 0.45
CYP17A1 P05093 2/20 0.45
TDP2 O95551 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
ALOX15 P16050 1/20 0.41
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HPGD P15428 1/20 0.39
RAF1 P04049 1/20 0.39
EPHX2 P34913 1/20 0.39
LIPE Q05469 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
SCHEMBL6049774 0.83 ALDH1A1 (0.46) KDM4EALDH1A1GAAALOX15RAB9A
SCHEMBL30682542 0.80 HPGD (0.55) NAMPTCYP17A1GAARAB9ASMN1; SMN2
SCHEMBL29614703 0.78 MEN1 (0.45) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4252286 0.78 MEN1 (0.45) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL28408407 0.78 KDM4E (0.39) KDM4EALDH1A1GAAALOX15RAB9A
SCHEMBL30448414 0.77 AXL (0.48) RAB9ASMN1; SMN2NPC1LMNAKMT2A
SCHEMBL30448108 0.77 RAB9A (0.46) ALDH1A1RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL30448073 0.76 KMT2A (0.51) NAMPTKDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL13855103 0.76 RAF1 (0.66) MEN1KMT2ARAF1EPHX2
SCHEMBL29131710 0.75 HPGD (0.59) NAMPTCYP17A1ALDH1A1GAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090124633-A1 N-OXIDES OF HETEROCYCLIC SUBSTITUTED BISARYLUREAS FOR TREATING KINASE-MEDIATED DISEASES MERCK PATENT GESELLSCHAFT (DE) 2009-05-14 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-20090124633-A1 N-OXIDES OF HETEROCYCLIC SUBSTITUTED BISARYLUREAS FOR TREATING KINASE-MEDIATED DISEASES ABL1, NME2, MAP3K1 NAMPT 416/4885METAP1 3236/4885CYP17A1 1220/4885

“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.