SCHEMBL24434802

SCHEMBL24434802

O=C(Nc1nc([C@H]2C[C@H]2c2ccccc2)cs1)c1cccn1Cc1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 4/20 0.42
KDM4E B2RXH2 2/20 0.40
HTT P42858 2/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 2/20 0.40
NPC1 O15118 2/20 0.40
POLB P06746 2/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 2/20 0.40
PARP1 P09874 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ROCK1 Q13464 4/20 0.39

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
SCHEMBL24435108 1.00 SCN3A (0.42) SCN3AKDM4EHTTLMNATP53
SCHEMBL24434939 0.93 SCN3A (0.42) SCN3AKDM4EHTTLMNATP53
SCHEMBL24435110 0.93 SCN3A (0.42) SCN3AKDM4EHTTLMNATP53
SCHEMBL24434811 0.91 SCN3A (0.41) SCN3AKDM4EHTTLMNATP53
SCHEMBL24434651 0.91 SCN3A (0.41) SCN3AKDM4EHTTLMNATP53
SCHEMBL24435176 0.91 SCN3A (0.41) SCN3AKDM4EHTTLMNATP53
SCHEMBL24435126 0.91 SCN3A (0.41) SCN3AKDM4EHTTLMNATP53
SCHEMBL31466228 0.90 POLB (0.40) KDM4EHTTLMNATP53NPC1
SCHEMBL24434932 0.89 SCN3A (0.42) SCN3AKDM4EHTTLMNATP53
SCHEMBL24435195 0.88 TMIGD3 (0.41) SCN3AKDM4EHTTLMNATP53

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-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 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-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G SCN3A 1699/4885KDM4E 4710/4885HTT 1728/4885

“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.