SCHEMBL30663229

SCHEMBL30663229

CCCCc1nc2c(N)nnc(SC(C)C)c2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.40
PI4K2B Q8TCG2 1/20 0.40
PI4K2A Q9BTU6 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
GSK3B P49841 1/20 0.31
PARP1 P09874 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
SCHEMBL29109863 1.00 PI4KA (0.40) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL29840892 0.77 TLR8 (0.41) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL30663228 0.77 PI4KA (0.39) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL32675794 0.77 PI4KA (0.39) PI4KAPI4K2BPI4K2API4KBALDH1A1
Hydrochloric Acid SCHEMBL29840678 0.76 TLR8 (0.40) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL32675775 0.71 NPY5R (0.41) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16486305 0.71 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBALDH1A1
Trifluoroacetic Acid SCHEMBL29840920 0.69 PI4KA (0.35) PI4KAPI4K2BPI4K2API4KB
SCHEMBL32675782 0.69 PI4KA (0.39) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL32675790 0.68 PI4KA (0.36) PI4KAPI4K2BPI4K2API4KB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4288438-B1 DERIVATIVES OF IMIDAZO[4,5-D]PYRIDAZINE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI SA (FR) 2026-02-18 EP claimed
CN-117098761-A Imidazo [4,5-d ] pyridazine derivatives, preparation thereof and therapeutic use thereof 赛诺菲 2023-11-21 CN claimed
US-12583861-B2 Derivatives of imidazo[4,5-d]pyridazine, their preparation and their therapeutic application SANOFI (FR) 2026-03-24 US disclosed
US-20240158401-A1 DERIVATIVES OF IMIDAZO[4,5-d]PYRIDAZINE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2024-05-16 US disclosed
CN-117098761-A Imidazo [4,5-d ] pyridazine derivatives, preparation thereof and therapeutic use thereof 赛诺菲 2023-11-21 CN 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 (2 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-12583861-B2 Derivatives of imidazo[4,5-d]pyridazine, their preparation and their therapeutic application TLR7, TLR8, TLR6 PI4KA 1721/4885PI4K2B 1955/4885PI4K2A 1910/4885
US-20240158401-A1 DERIVATIVES OF IMIDAZO[4,5-d]PYRIDAZINE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION TLR7, TLR8, TLR6 PI4KA 2368/4885PI4K2B 2718/4885PI4K2A 2638/4885

“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.