SCHEMBL29326596

SCHEMBL29326596

Cc1nc(N[C@H]2CCNC2=O)nnc1-c1ccc(Cl)cc1O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IL1B P01584 4/20 0.40
SCN9A Q15858 4/20 0.36
FPR2 P25090 1/20 0.36
NLRP3 Q96P20 2/20 0.35
ABL1 P00519 1/20 0.33
DPP4 P27487 1/20 0.33
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
PDCD1LG2 Q9BQ51 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
SHMT1 P34896 1/20 0.32
SHMT2 P34897 1/20 0.32
CCNT1 O60563 2/20 0.32
CDK9 P50750 2/20 0.32
HPGDS O60760 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
SCHEMBL29326601 0.89 NLRP3 (0.35) IL1BSCN9AFPR2NLRP3PIM1
SCHEMBL29326790 0.88 HPGDS (0.38) IL1BSCN9AFPR2NLRP3HPGDS
SCHEMBL29326505 0.85 NLRP3 (0.49) IL1BSCN9AFPR2NLRP3
SCHEMBL29326501 0.85 NLRP3 (0.49) IL1BSCN9AFPR2NLRP3
SCHEMBL29326604 0.82 SCN9A (0.47) IL1BSCN9AFPR2NLRP3HPGDS
SCHEMBL29326508 0.79 NLRP3 (0.48) IL1BSCN9ANLRP3PIM1PIM2
SCHEMBL29326496 0.79 NLRP3 (0.48) IL1BSCN9ANLRP3PIM1PIM2
SCHEMBL29326512 0.79 NLRP3 (0.47) IL1BNLRP3
SCHEMBL26434544 0.76 IL1B (0.47) IL1BNLRP3
SCHEMBL29325902 0.76 SCN9A (0.33) SCN9APIM1PIM2PDCD1LG2CD274

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 IL1B 11/4885SCN9A 3093/4885FPR2 169/4885

“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.