SCHEMBL25338261

SCHEMBL25338261

Cn1c(=O)[nH]c2cccc(C3CC(CO[C@H]4CCN(C(=O)O)C[C@@H]4F)C3)c21

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.33
OPRM1 P35372 2/20 0.33
ALDH1A1 P00352 1/20 0.31
HSD11B1 P28845 3/20 0.31
KMT2A Q03164 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL25339428 1.00 ADRB2 (0.33) ADRB2OPRM1ALDH1A1HSD11B1KMT2A
SCHEMBL30543604 0.89 GPR119 (0.40)
SCHEMBL26766227 0.89 GPR119 (0.40)
SCHEMBL30543618 0.89 GPR119 (0.40)
SCHEMBL26766291 0.89 GPR119 (0.40)
SCHEMBL25339574 0.84 ADRB2 (0.33) ADRB2OPRM1
SCHEMBL25335842 0.79 ADRB2 (0.39) ADRB2OPRM1ALDH1A1HSD11B1
SCHEMBL25339124 0.79 ADRB2 (0.39) ADRB2OPRM1ALDH1A1HSD11B1
SCHEMBL25340065 0.79 ADRB2 (0.36) ADRB2OPRM1HSD11B1CHRM2CHRM4
SCHEMBL25339166 0.79 ADRB2 (0.36) ADRB2OPRM1HSD11B1CHRM2CHRM4

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-20230365562-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-11-16 US disclosed
WO-2023147594-A2 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-08-03 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-20230365562-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ADRB2 4578/4885OPRM1 4472/4885ALDH1A1 2776/4885

“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.