SCHEMBL25554143

SCHEMBL25554143

Cc1ccc2c(c1)CC(CO)CC2

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.42
TRPM5 Q9NZQ8 2/20 0.38
SRD5A1 P18405 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
DRD2 P14416 9/20 0.38
DRD3 P35462 9/20 0.38
DRD4 P21917 6/20 0.38
MCHR1 Q99705 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTR1A P08908 1/20 0.37
ADRB2 P07550 1/20 0.37
CYP2D6 P10635 1/20 0.37
CASP1 P29466 1/20 0.37
CYP26A1 O43174 1/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL20584776 0.85 TRPM5 (0.42) CYP19A1TRPM5
SCHEMBL30492694 0.85 TRPM5 (0.42) CYP19A1TRPM5
SCHEMBL14922880 0.80 MCHR1 (0.52) DRD2DRD3DRD4MCHR1
SCHEMBL9630417 0.79 CYP19A1 (0.63) CYP19A1DRD2DRD3DRD4HTR1A
SCHEMBL19186568 0.77 MCHR1 (0.41) CYP19A1SRD5A1ALDH1A1CYP3A4DRD2
SCHEMBL10130323 0.77 DRD2 (0.45) SRD5A1ALDH1A1CYP3A4DRD2DRD3
SCHEMBL10289245 0.76 MCHR1 (0.40) CYP19A1SRD5A1ALDH1A1CYP3A4MCHR1
SCHEMBL6570371 0.76 CYP19A1 (0.54) CYP19A1HTR1A
SCHEMBL15701675 0.76 CYP19A1 (0.54) CYP19A1HTR1A
SCHEMBL1689627 0.76 CYP19A1 (0.54) CYP19A1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167057-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-06-01 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 (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-20230167057-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 CYP19A1 3649/4885TRPM5 167/4885SRD5A1 3903/4885

“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.