SCHEMBL29326601

SCHEMBL29326601

Cc1ccc(-c2nnc(N[C@H]3CCNC3=O)nc2C)c(O)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 7/20 0.35
IL1B P01584 1/20 0.35
RAB9A P51151 1/20 0.34
SYK P43405 2/20 0.34
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
SCN9A Q15858 2/20 0.33
PARP10 Q53GL7 1/20 0.33
PARP11 Q9NR21 1/20 0.33
HPGDS O60760 3/20 0.32
LMNA P02545 1/20 0.32
FPR2 P25090 1/20 0.32
CHEK2 O96017 1/20 0.32

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
SCHEMBL29326596 0.89 IL1B (0.40) NLRP3IL1BPIM1PIM2SCN9A
SCHEMBL29326501 0.87 NLRP3 (0.49) NLRP3IL1BSYKSCN9AFPR2
SCHEMBL29326505 0.87 NLRP3 (0.49) NLRP3IL1BSYKSCN9AFPR2
SCHEMBL29326604 0.84 SCN9A (0.47) NLRP3IL1BSYKSCN9AHPGDS
SCHEMBL29326508 0.81 NLRP3 (0.48) NLRP3IL1BSYKPIM1PIM2
SCHEMBL29326496 0.81 NLRP3 (0.48) NLRP3IL1BSYKPIM1PIM2
SCHEMBL29326512 0.80 NLRP3 (0.47) NLRP3IL1BRAB9ASYK
SCHEMBL29326790 0.77 HPGDS (0.38) NLRP3IL1BSCN9AHPGDSFPR2
SCHEMBL26434281 0.75 NLRP3 (0.38) NLRP3IL1BLMNA
SCHEMBL26434277 0.74 NLRP3 (0.51) NLRP3IL1BLMNA

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-20240239758-A1 SUBSTITUTED TRIAZINE COMPOUND NICO THERAPEUTICS, INC. 2024-07-18 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-20240239758-A1 SUBSTITUTED TRIAZINE COMPOUND NLRP3, NLRP1, PYCARD NLRP3 1/4885IL1B 11/4885RAB9A 4452/4885

“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.