SCHEMBL29326237

SCHEMBL29326237

Cc1nc(N[C@H]2CCC[C@@H](O)C2)nnc1Cl

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 11/20 0.39
MAPK9 P45984 6/20 0.37
CCNT1 O60563 1/20 0.36
CDK2 P24941 1/20 0.36
CDK7 P50613 1/20 0.36
CDK9 P50750 1/20 0.36
IL1B P01584 3/20 0.35
TNF P01375 1/20 0.35
PTPN11 Q06124 3/20 0.35
PTGES O14684 1/20 0.35
PDE4A P27815 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
SCHEMBL29155917 1.00 MAPK8 (0.39) MAPK8MAPK9CCNT1CDK2CDK7
SCHEMBL29326234 1.00 MAPK8 (0.39) MAPK8MAPK9CCNT1CDK2CDK7
SCHEMBL29325964 1.00 MAPK8 (0.39) MAPK8MAPK9CCNT1CDK2CDK7
SCHEMBL30684778 1.00 MAPK8 (0.39) MAPK8MAPK9CCNT1CDK2CDK7
SCHEMBL29155922 1.00 MAPK8 (0.39) MAPK8MAPK9CCNT1CDK2CDK7
SCHEMBL29325972 0.97 MAPK8 (0.39) MAPK8MAPK9CCNT1CDK2CDK7
SCHEMBL29325879 0.91 IRAK4 (0.35) MAPK8MAPK9CCNT1CDK9PTPN11
SCHEMBL29325872 0.91 IRAK4 (0.35) MAPK8MAPK9CCNT1CDK9PTPN11
SCHEMBL29325869 0.82 MAPK10 (0.36) MAPK8MAPK9CDK2CDK7CDK9
SCHEMBL29325826 0.82 PDE4A (0.50) PDE4A

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 MAPK8 3960/4885MAPK9 4007/4885CCNT1 4718/4885

“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.