SCHEMBL22338149

SCHEMBL22338149

CC(C)NC(=O)CNc1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
FDPS P14324 1/20 0.48
POLB P06746 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
PKM P14618 1/20 0.46
CYP2D6 P10635 1/20 0.45
CXCR4 P61073 1/20 0.45
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
CYP2C19 P33261 1/20 0.44
FABP1 P07148 1/20 0.44
FABP6 P51161 1/20 0.44
HPGD P15428 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
SCHEMBL22338218 0.82 GAA (0.56) GAAFDPSNPC1RAB9APKM
SCHEMBL13588768 0.81 ALDH1A1 (0.50) GAAFDPSPOLBNPC1RAB9A
SCHEMBL25083223 0.79 GAA (0.53) GAAFDPSL3MBTL1NPC1RAB9A
SCHEMBL28643003 0.79 GAA (0.56) GAAFDPSL3MBTL1NPC1RAB9A
SCHEMBL13589538 0.78 GAA (0.55) GAAFDPSNPC1RAB9APKM
SCHEMBL9722609 0.78 GAA (0.58) GAAFDPSNPC1RAB9APKM
SCHEMBL7748124 0.77 GAA (0.50) GAAFDPSPOLBNPC1RAB9A
SCHEMBL534155 0.76 GAA (0.56) GAAFDPSL3MBTL1NPC1RAB9A
Hydrochloric Acid SCHEMBL360682 0.76 GAA (0.56) GAAFDPSL3MBTL1NPC1RAB9A
SCHEMBL12376732 0.76 RAB9A (0.60) GAAPOLBNPC1RAB9APKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230063768-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-03-02 US disclosed
WO-2020163594-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-08-13 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-20230063768-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF PMP22, MAG, FABP7 GAA 540/4885FDPS 2120/4885POLB 4340/4885

“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.