SCHEMBL23869609

SCHEMBL23869609

CN(CC(=O)OCc1ccccc1)C1(C)CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TACR1 P25103 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
USP30 Q70CQ3 2/20 0.41
YAP1 P46937 1/20 0.40
SCD5 Q86SK9 1/20 0.40
HTT P42858 1/20 0.39
TLR9 Q9NR96 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
CYP11B2 P19099 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
STS P08842 1/20 0.39
RORC P51449 1/20 0.38

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
SCHEMBL30810207 0.85 TACR1 (0.43) MEN1KMT2ATACR1OPRD1OPRK1
SCHEMBL18163700 0.84 MEN1 (0.47) MEN1KMT2ATACR1OPRD1OPRK1
SCHEMBL30929236 0.81 MEN1 (0.44) MEN1KMT2AOPRD1OPRK1HTT
SCHEMBL616090 0.79 SCD5 (0.52) MEN1KMT2ATACR1OPRD1OPRK1
SCHEMBL25447134 0.79 MEN1 (0.49) MEN1KMT2ATACR1OPRD1OPRK1
SCHEMBL30922395 0.79 JAK2 (0.48) TACR1OPRD1OPRK1JAK2JAK1
SCHEMBL28983636 0.79 MEN1 (0.46) MEN1KMT2ATACR1OPRD1OPRK1
SCHEMBL23582844 0.78 MEN1 (0.46) MEN1KMT2ATACR1OPRD1OPRK1
SCHEMBL23869608 0.78 MEN1 (0.52) MEN1KMT2ATACR1OPRD1OPRK1
SCHEMBL18154126 0.78 TACR1 (0.44) MEN1KMT2ATACR1OPRD1OPRK1

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-20210300906-A1 PYRAZOLE DERIVATIVES AS H4 ANTAGONIST COMPOUNDS NXERA PHARMA UK LIMITED (GB) 2021-09-30 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-20210300906-A1 PYRAZOLE DERIVATIVES AS H4 ANTAGONIST COMPOUNDS HRH4, HRH3, HDAC3 MEN1 2770/4885KMT2A 1080/4885TACR1 335/4885

“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.