SCHEMBL22130596

SCHEMBL22130596

CC1OC(C)C2C(=O)N(CCN/C(N)=N\C(=O)OC(C)(C)C)C(=O)C12

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
NPC1 O15118 2/20 0.31
ALDH1A1 P00352 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TP53 P04637 1/20 0.30
AKT1 P31749 1/20 0.30

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
SCHEMBL22100089 0.88 OPRM1 (0.43) OPRM1OPRD1OPRK1NPC1ALDH1A1
SCHEMBL22100058 0.75 OPRM1 (0.43) OPRM1OPRD1OPRK1NPC1ALDH1A1
SCHEMBL24746973 0.75 ALDH1A1 (0.47) NPC1ALDH1A1RAB9ASMN1; SMN2TP53
SCHEMBL25857137 0.73 OPRM1 (0.41) OPRM1OPRD1OPRK1NPC1ALDH1A1
SCHEMBL19388140 0.73 OPRM1 (0.41) OPRM1OPRD1OPRK1NPC1ALDH1A1
SCHEMBL25857161 0.70 KDM4E (0.32) ALDH1A1AKT1
SCHEMBL22863834 0.70 OPRM1 (0.47) OPRM1OPRD1OPRK1NPC1ALDH1A1
SCHEMBL18666981 0.70 OPRM1 (0.47) OPRM1OPRD1OPRK1NPC1ALDH1A1
SCHEMBL20125232 0.70 MAOA (0.36) ALDH1A1
SCHEMBL26769418 0.70 MAOA (0.36) ALDH1A1

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-10688189-B1 Modulated guanidine-containing polymers or nanoparticles THE FLORIDA INTERNATIONAL BOARD OF TRUSTEES (US) 2020-06-23 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-10688189-B1 Modulated guanidine-containing polymers or nanoparticles RNMT, NAT10, GMPS OPRM1 478/4885OPRD1 2498/4885OPRK1 1267/4885

“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.