SCHEMBL23166366

SCHEMBL23166366

O=[N+]([O-])c1c[nH]c2ccncc12

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.45
CHUK O15111 1/20 0.43
NOS1 P29475 1/20 0.42
HTT P42858 4/20 0.42
MAPT P10636 4/20 0.42
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 3/20 0.40
HIPK2 Q9H2X6 1/20 0.39
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
NFATC1 O95644 1/20 0.38
GSK3B P49841 1/20 0.38
DYRK1A Q13627 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL23166408 0.91 HTR6 (0.42) HTR6CHUKNOS1HTTMAPT
SCHEMBL23166049 0.89 HTR6 (0.38) HTR6CHUKNOS1HTTMAPT
SCHEMBL30861100 0.86 CHUK (0.50) CHUKNOS1HTTMAPTLMNA
SCHEMBL1004938 0.86 CHUK (0.50) CHUKNOS1HTTMAPTLMNA
SCHEMBL24196331 0.80 ALDH1A1 (0.44) CHUKHTTMAPTLMNAPOLB
SCHEMBL1849779 0.74 NPC1 (0.51) HTTMAPTLMNAALDH1A1RAB9A
SCHEMBL11817125 0.72 MAPT (0.64) CHUKHTTMAPTLMNAPOLB
SCHEMBL2181204 0.69 MET (0.62) HTTMAPTLMNAPOLBALDH1A1
SCHEMBL15792482 0.69 GPR84 (0.50) KMT2A
SCHEMBL24214820 0.69 GPR84 (0.50) MAPTGSK3BDYRK1AMEN1KMT2A

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-20230002373-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-01-05 US disclosed
WO-2021067791-A1 OXALAMIDE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2021-04-08 WO 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-20230002373-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 HTR6 469/4885CHUK 278/4885NOS1 770/4885

“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.