SCHEMBL31725152

SCHEMBL31725152

CC(C)(C)OC(=O)NCCOc1ccccc1-c1cc(N)no1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.48
HSD17B10 Q99714 3/20 0.48
ALDH1A1 P00352 3/20 0.48
RAB9A P51151 2/20 0.48
KDM4E B2RXH2 2/20 0.48
PDK2 Q15119 1/20 0.46
SCN9A Q15858 1/20 0.45
CNR2 P34972 10/20 0.45
FAAH O00519 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL31725014 0.94 CNR2 (0.48) HPGDHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL8377397 0.82 HSD17B10 (0.58) HPGDHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL31725139 0.78 KCNH2 (0.51) HPGDHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL8377366 0.78 PDK2 (0.46) HPGDHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL8377376 0.77 PDK2 (0.46) HPGDHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL25470614 0.76 SCN9A (0.50) HPGDALDH1A1RAB9APDK2SCN9A
SCHEMBL31296532 0.76 SCN9A (0.50) HPGDALDH1A1RAB9APDK2SCN9A
SCHEMBL8380157 0.76 PDK2 (0.48) HPGDHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL8375694 0.76 NQO2 (0.44) HPGDHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL31724954 0.75 RAB9A (0.42) HPGDHSD17B10ALDH1A1RAB9AKDM4E

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-20250346587-A1 NITROGEN-CONTAINING FIVE-MEMBERED HETEROCYCLIC DERIVATIVES AS CHECKPOINT KINASE 1 INHIBITOR AND USES THEREOF SPEROGENIX THERAPEUTICS LTD (CN) 2025-11-13 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-20250346587-A1 NITROGEN-CONTAINING FIVE-MEMBERED HETEROCYCLIC DERIVATIVES AS CHECKPOINT KINASE 1 INHIBITOR AND USES THEREOF CHEK1, CHEK2, BUB1 HPGD 1720/4885HSD17B10 2812/4885ALDH1A1 2826/4885

“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.