SCHEMBL25966739

SCHEMBL25966739

CC(C)c1c2cccnc2nn1C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 7/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ MAOB P27338 7/20 0.34
▸ KAT2A Q92830 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL25966746 0.78 HTR2C (0.35) KAT2BNPC1L3MBTL1IDO1MAOB
SCHEMBL21297851 0.76 L3MBTL1 (0.42) KAT2BNPC1HSP90AA1L3MBTL1IDO1
SCHEMBL12439934 0.74 L3MBTL1 (0.36) KAT2BNPC1HSP90AA1L3MBTL1MAOB
Ammonia Solution, Strong SCHEMBL28358675 0.74 L3MBTL1 (0.41) KAT2BNPC1HSP90AA1L3MBTL1MAOB
SCHEMBL31221234 0.72 BRD4 (0.43) NPC1HSP90AA1L3MBTL1KDM4EMAPT
SCHEMBL10129331 0.72 ADORA3 (0.43) ADORA3ADORA1KDM4EMAPT
SCHEMBL23067956 0.71 GRM4 (0.41) KAT2BADORA3ADORA1NPC1HSP90AA1
SCHEMBL570108 0.69 KDM4E (0.41) KAT2BL3MBTL1MAOBKDM4EMAPT
SCHEMBL26129508 0.69 PAK4 (0.39) ADORA3ADORA1HSP90AA1IDO1MAPT
SCHEMBL10218715 0.68 PIK3CG (0.43) KAT2BADORA3ADORA1NPC1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 — — US disclosed
US-20230250060-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 — — 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 (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-20230250060-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 KAT2B 3238/4885ADORA3 2176/4885ADORA1 1295/4885
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 KAT2B 3185/4885ADORA3 2193/4885ADORA1 1338/4885

“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.

Send feedback