SCHEMBL29325869

SCHEMBL29325869

Cc1nc(N[C@H]2CC[C@H](O)CC2)nnc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 5/20 0.36
JUN P05412 1/20 0.36
MAPK8 P45983 7/20 0.36
MAPK9 P45984 6/20 0.36
ADORA1 P30542 2/20 0.36
PDE2A O00408 1/20 0.35
PDE10A Q9Y233 1/20 0.35
GSK3A P49840 3/20 0.34
GSK3B P49841 3/20 0.34
MERTK Q12866 3/20 0.34
AXL P30530 2/20 0.34
TYRO3 Q06418 2/20 0.34
LCK P06239 2/20 0.34
CDK2 P24941 2/20 0.34
FLT3 P36888 2/20 0.34
ITK Q08881 2/20 0.34
IRAK4 Q9NWZ3 2/20 0.34
RIPK2 O43353 1/20 0.34
CDC7 O00311 1/20 0.34
CHEK1 O14757 1/20 0.34

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
SCHEMBL29325879 0.91 IRAK4 (0.35) MAPK10JUNMAPK8MAPK9GSK3A
SCHEMBL29325872 0.91 IRAK4 (0.35) MAPK10JUNMAPK8MAPK9GSK3A
SCHEMBL29325826 0.83 PDE4A (0.50) PDE10AMAPK1PDE4A
SCHEMBL29155917 0.82 MAPK8 (0.39) MAPK8MAPK9CDK2CDK7CDK9
SCHEMBL29325964 0.82 MAPK8 (0.39) MAPK8MAPK9CDK2CDK7CDK9
SCHEMBL29325972 0.82 MAPK8 (0.39) MAPK8MAPK9PDE10ACDK2MAPK1
SCHEMBL29326237 0.82 MAPK8 (0.39) MAPK8MAPK9CDK2CDK7CDK9
SCHEMBL29155922 0.82 MAPK8 (0.39) MAPK8MAPK9CDK2CDK7CDK9
SCHEMBL30684778 0.82 MAPK8 (0.39) MAPK8MAPK9CDK2CDK7CDK9
SCHEMBL29326234 0.82 MAPK8 (0.39) MAPK8MAPK9CDK2CDK7CDK9

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 MAPK10 3974/4885JUN 964/4885MAPK8 3960/4885

“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.