SCHEMBL29326610

SCHEMBL29326610

Cc1nc(N[C@H]2CCN(C)C2=O)nnc1-c1ccc(C(F)(F)F)cc1O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 8/20 0.48
IL1B P01584 12/20 0.48
KCNH2 Q12809 1/20 0.44
TNF P01375 1/20 0.42
SCN9A Q15858 1/20 0.38
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL29326501 0.82 NLRP3 (0.49) NLRP3IL1BKCNH2TNFSCN9A
SCHEMBL29326505 0.82 NLRP3 (0.49) NLRP3IL1BKCNH2TNFSCN9A
SCHEMBL29326496 0.80 NLRP3 (0.48) NLRP3IL1BKCNH2TNFSCN9A
SCHEMBL29326508 0.80 NLRP3 (0.48) NLRP3IL1BKCNH2TNFSCN9A
SCHEMBL29975632 0.79 NLRP3 (0.55) NLRP3IL1BKCNH2TNF
SCHEMBL29326512 0.79 NLRP3 (0.47) NLRP3IL1BKCNH2TNF
SCHEMBL29975639 0.79 IL1B (0.73) NLRP3IL1B
SCHEMBL25856246 0.79 IL1B (0.73) NLRP3IL1B
SCHEMBL30295387 0.79 IL1B (0.73) NLRP3IL1B
SCHEMBL26092859 0.79 IL1B (0.73) NLRP3IL1B

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 11/4885KCNH2 2120/4885

“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.