SCHEMBL23311652

SCHEMBL23311652

Cc1ncc(NC2CCN(C(=O)OC(C)(C)C)CC2)cn1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
NPC1 O15118 1/20 0.61
MAPT P10636 1/20 0.61
MAPK1 P28482 1/20 0.61
HTT P42858 1/20 0.61
RAB9A P51151 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
GPR119 Q8TDV5 8/20 0.52
JAK1 P23458 1/20 0.51
EPHX1 P07099 1/20 0.50
PTPN2 P17706 1/20 0.49
PTPN1 P18031 1/20 0.49
PTPN6 P29350 1/20 0.49
USP30 Q70CQ3 1/20 0.47
BTK Q06187 1/20 0.47
CNR1 P21554 1/20 0.47

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
SCHEMBL16976307 0.86 ALDH1A1 (0.65) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL1879959 0.86 ALDH1A1 (0.64) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL1873288 0.83 ALDH1A1 (0.56) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL4240888 0.83 ALDH1A1 (0.64) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL1878512 0.83 GPR119 (0.57) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL25273779 0.82 ALDH1A1 (0.69) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL21606962 0.82 ALDH1A1 (0.62) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL30914985 0.82 ALDH1A1 (0.56) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL4115820 0.82 ALDH1A1 (0.77) ALDH1A1NPC1MAPTMAPK1HTT
SCHEMBL21525140 0.81 ALDH1A1 (0.59) ALDH1A1NPC1MAPTMAPK1HTT

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-20210122763-A1 OGA INHIBITOR COMPOUNDS JANSSEN-CILAG S.A. (ES) 2021-04-29 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-20210122763-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN ALDH1A1 3839/4885NPC1 1281/4885MAPT 7/4885

“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.