SCHEMBL17153132

SCHEMBL17153132

CC(C)(C)OC(=O)N1CCNC(C(=O)OCc2ccccc2)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
CTSL P07711 1/20 0.46
PARP1 P09874 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
GPR119 Q8TDV5 3/20 0.44
STS P08842 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
HTT P42858 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
SCHEMBL28514838 0.89 JAK2 (0.47) JAK2JAK1PARP1MEN1KMT2A
SCHEMBL10281640 0.86 TSHR (0.48) MEN1KMT2ATSHR
SCHEMBL3655587 0.86 TSHR (0.47) MEN1KMT2ATSHR
SCHEMBL14646669 0.84 SMN1; SMN2 (0.52) MEN1KMT2AHTT
SCHEMBL12324603 0.84 SMN1; SMN2 (0.52) MEN1KMT2AHTT
SCHEMBL2680992 0.84 SMN1; SMN2 (0.52) MEN1KMT2AHTT
Hydrochloric Acid SCHEMBL29121517 0.83 SMN1; SMN2 (0.51) MEN1KMT2ATSHRHTT
SCHEMBL17112940 0.82 SMN1; SMN2 (0.55) MEN1KMT2AGPR119STSL3MBTL1
SCHEMBL15626861 0.81 STS (0.56) JAK2JAK1CTSLGPR119STS
SCHEMBL951309 0.81 STS (0.56) JAK2JAK1CTSLGPR119STS

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
US-10017509-B2 Macrocylic pyrimidine derivatives JANSSEN PHARMACEUTICA NV (BE) 2018-07-10 US disclosed
EP-3126364-B1 MACROCYLIC PYRIMIDINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2018-02-07 EP disclosed
WO-2015150555-A1 MACROCYLIC PYRIMIDINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2015-10-08 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-10017509-B2 Macrocylic pyrimidine derivatives EEF2K, VPS26B, VPS28 JAK2 2654/4885JAK1 2177/4885CTSL 1366/4885

“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.