SCHEMBL23622949

SCHEMBL23622949

O=C(O)c1c[nH]c2ccc(CCO)cc12

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 6/20 0.63
PRKAG1 P54619 6/20 0.63
PRKAA2 P54646 6/20 0.63
PRKAA1 Q13131 6/20 0.63
PRKAG3 Q9UGI9 6/20 0.63
PRKAG2 Q9UGJ0 6/20 0.63
PRKAB1 Q9Y478 6/20 0.63
F7 P08709 1/20 0.57
F3 P13726 1/20 0.57
KDM4E B2RXH2 1/20 0.48
GABRA1 P14867 4/20 0.47
GABRB2 P47870 4/20 0.47
NHERF1 O14745 2/20 0.45
LMNA P02545 1/20 0.44
RAB9A P51151 1/20 0.44
HTR2C P28335 1/20 0.44

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
SCHEMBL2056326 0.82 GABRA1 (0.63) F7F3GABRA1GABRB2
SCHEMBL15901066 0.81 HAT1 (0.47) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL6648434 0.81 GABRA1 (0.46) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL15902428 0.80 HAT1 (0.52)
SCHEMBL30934603 0.79 F7 (0.55) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL25253727 0.79 F7 (0.55) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL25215041 0.79 STING1 (0.43) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL6139981 0.78 GABRA1 (0.50) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL15300878 0.78 PRKAB2 (1.00) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL3812183 0.77 HTT (0.52) KDM4EGABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230127839-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-04-27 US disclosed
US-20230127839-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-04-27 US disclosed
WO-2021138434-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2021-07-08 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-20230127839-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 PRKAB2 158/4885PRKAG1 57/4885PRKAA2 452/4885

“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.