SCHEMBL25966735

SCHEMBL25966735

CC(C)c1nn(C)c2cccnc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.36
KAT2B Q92831 5/20 0.35
NAMPT P43490 1/20 0.35
MAPK14 Q16539 2/20 0.35
MAPK13 O15264 1/20 0.35
EIF2AK2 P19525 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA2A P29274 1/20 0.35
HSP90AA1 P07900 2/20 0.34
NPC1 O15118 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
IDO1 P14902 1/20 0.34
KAT2A Q92830 1/20 0.34
GRM4 Q14833 4/20 0.34
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 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
SCHEMBL25979760 0.81 HSP90AA1 (0.33) ADORA3ADORA2AHSP90AA1NPC1L3MBTL1
SCHEMBL14074978 0.78 SSTR4 (0.38) SSTR4NAMPTMAPK14ADORA3ADORA2A
SCHEMBL31052526 0.76 HSP90AA1 (0.43) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL1577651 0.76 GRM4 (0.43) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL17045432 0.76 HSP90AA1 (0.43) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL31298611 0.74 HSP90AA1 (0.38) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL14074980 0.74 SSTR4 (0.38) SSTR4KAT2BNAMPTMAPK14ADORA3
SCHEMBL21937447 0.72 PIK3CG (0.39) PIK3CG
SCHEMBL2738313 0.72 KDM4E (0.49) SSTR4MAPK14MAPK13EIF2AK2MAPK12
SCHEMBL10218715 0.71 PIK3CG (0.43) SSTR4KAT2BNAMPTADORA3HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ANTARES THERAPEUTICS, INC. 2023-11-16 US disclosed
US-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ANTARES THERAPEUTICS, INC. 2023-11-16 US disclosed
US-20230250060-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 US disclosed
US-20230250088-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 (3 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-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ERBB2, EGFR, ERBB3 SSTR4 962/4885KAT2B 3927/4885NAMPT 3699/4885
US-20230250060-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 SSTR4 4406/4885KAT2B 3238/4885NAMPT 2899/4885
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 SSTR4 4433/4885KAT2B 3185/4885NAMPT 2906/4885

“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.