SCHEMBL29325872

SCHEMBL29325872

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

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.35
MAPK8 P45983 7/20 0.35
MKNK1 Q9BUB5 4/20 0.34
MKNK2 Q9HBH9 4/20 0.34
CCNT1 O60563 1/20 0.33
CDK9 P50750 1/20 0.33
TYRO3 Q06418 2/20 0.33
MERTK Q12866 2/20 0.33
FLT3 P36888 1/20 0.33
GAS6 Q14393 1/20 0.33
AXL P30530 1/20 0.33
PTPN11 Q06124 3/20 0.32
MAPK9 P45984 4/20 0.32
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
JUN P05412 1/20 0.30
MAPK10 P53779 1/20 0.30

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 1.00 IRAK4 (0.35) IRAK4MAPK8MKNK1MKNK2CCNT1
SCHEMBL29325964 0.91 MAPK8 (0.39) MAPK8CCNT1CDK9PTPN11MAPK9
SCHEMBL29326234 0.91 MAPK8 (0.39) MAPK8CCNT1CDK9PTPN11MAPK9
SCHEMBL29155922 0.91 MAPK8 (0.39) MAPK8CCNT1CDK9PTPN11MAPK9
SCHEMBL29155917 0.91 MAPK8 (0.39) MAPK8CCNT1CDK9PTPN11MAPK9
SCHEMBL29325972 0.91 MAPK8 (0.39) MAPK8CCNT1CDK9PTPN11MAPK9
SCHEMBL29326237 0.91 MAPK8 (0.39) MAPK8CCNT1CDK9PTPN11MAPK9
SCHEMBL30684778 0.91 MAPK8 (0.39) MAPK8CCNT1CDK9PTPN11MAPK9
SCHEMBL29325869 0.91 MAPK10 (0.36) IRAK4MAPK8MKNK2CDK9TYRO3
SCHEMBL31039775 0.81 CCNK (0.34) CCNT1CDK9

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 IRAK4 47/4885MAPK8 3960/4885MKNK1 1174/4885

“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.