SCHEMBL24631035

SCHEMBL24631035

CC(C)(CO)NC[C@H](O)c1cccc2[nH]nc(F)c12

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 8/20 0.36
▸ ADRB1 P08588 6/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ ADRB3 P13945 2/20 0.35
▸ ADRA2A P08913 1/20 0.34
▸ ADRA2B P18089 1/20 0.34
▸ ADRA2C P18825 1/20 0.34
▸ GRK3 P35626 2/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ BCR P11274 1/20 0.32

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
SCHEMBL22864107 0.89 ADRB2 (0.48) ADRB2ADRB1CYP2D6NFKB1HIF1A
SCHEMBL24630913 0.87 ADRB2 (0.37) ADRB2ADRB1CYP2D6NFKB1HIF1A
SCHEMBL24630918 0.80 ADRB1 (0.47) ADRB2ADRB1CYP2D6HIF1AADRB3
SCHEMBL24630994 0.79 ADRB2 (0.36) ADRB2ADRB1ADRB3ADRA2AADRA2B
SCHEMBL24630999 0.77 SIGMAR1 (0.38) ADRB2ADRB1ADRB3ADRA2AADRA2B
SCHEMBL24630929 0.76 ADRB1 (0.34) ADRB2ADRB1ADRB3ADRA2AADRA2B
SCHEMBL22864071 0.76 IDO1 (0.55) ADRB2ADRB1CYP2D6NFKB1HIF1A
SCHEMBL22864140 0.75 ADRB2 (0.49) ADRB2ADRB1CYP2D6NFKB1HIF1A
SCHEMBL24631001 0.75 ADRB2 (0.46) ADRB2ADRB1CYP2D6NFKB1HIF1A
SCHEMBL24631006 0.75 ADRB1 (0.47) ADRB2ADRB1CYP2D6NFKB1HIF1A

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-20220315534-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. 2022-10-06 — — 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-20220315534-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRB2, ADRB1, ADRA2C ADRB2 1/4885ADRB1 2/4885CYP2D6 946/4885

“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.

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