SCHEMBL29325904

SCHEMBL29325904

Cc1nc(N[C@H]2CCNC2=O)nnc1Cl

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.33
PDCD1LG2 Q9BQ51 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
HPGDS O60760 2/20 0.32
SYK P43405 2/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
HSD11B1 P28845 1/20 0.31

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
SCHEMBL29325902 1.00 SCN9A (0.33) SCN9APDCD1LG2CD274HPGDSSYK
SCHEMBL29325906 0.92 PIM1 (0.38) HPGDSADORA2AADORA1MKNK1MKNK2
SCHEMBL29325911 0.91 ADORA2A (0.41) ADORA2AADORA1MKNK1MKNK2PIM1
SCHEMBL29326596 0.76 IL1B (0.40) SCN9APDCD1LG2CD274HPGDSPIM1
SCHEMBL16000542 0.75 SCN9A (0.38) SCN9APDCD1LG2CD274HPGDSDDB1
SCHEMBL29325961 0.73 LIPG (0.32) HPGDS
SCHEMBL29325948 0.71 MKNK1 (0.36) PDCD1LG2CD274MKNK1MKNK2
SCHEMBL29326100 0.71 HSD11B1 (0.37) SCN9AHPGDSDDB1CRBNMKNK1
SCHEMBL29325944 0.71 MKNK1 (0.36) PDCD1LG2CD274MKNK1MKNK2
SCHEMBL29325826 0.69 PDE4A (0.50)

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 SCN9A 3093/4885PDCD1LG2 3793/4885CD274 3095/4885

“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.