SCHEMBL29325906

SCHEMBL29325906

Cc1nc(N[C@H]2CCCNC2=O)nnc1Cl

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
MKNK1 Q9BUB5 2/20 0.36
MKNK2 Q9HBH9 2/20 0.36
CCR2 P41597 8/20 0.36
RAB9A P51151 2/20 0.35
HTT P42858 1/20 0.35
SELP P16109 1/20 0.33
TYRO3 Q06418 1/20 0.33
NPC1 O15118 1/20 0.33
HPGDS O60760 1/20 0.32
LIPG Q9Y5X9 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
SCHEMBL29325911 0.96 ADORA2A (0.41) PIM1PIM2ADORA2AADORA1MKNK1
SCHEMBL29325904 0.92 SCN9A (0.33) PIM1PIM2ADORA2AADORA1MKNK1
SCHEMBL29325902 0.92 SCN9A (0.33) PIM1PIM2ADORA2AADORA1MKNK1
SCHEMBL25301974 0.72 CCNT1 (0.43)
SCHEMBL25301972 0.72 CCNT1 (0.43)
SCHEMBL29325961 0.71 LIPG (0.32) HPGDSLIPG
SCHEMBL29325826 0.70 PDE4A (0.50) RAB9AHTTNPC1
SCHEMBL29325948 0.69 MKNK1 (0.36) MKNK1MKNK2
SCHEMBL29325944 0.69 MKNK1 (0.36) MKNK1MKNK2
SCHEMBL16000542 0.67 SCN9A (0.38) MKNK1MKNK2HPGDSLIPG

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 PIM1 3062/4885PIM2 3454/4885ADORA2A 586/4885

“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.