SCHEMBL24630951

SCHEMBL24630951

CC(C)(C)NC[C@H](O)c1ccc2c(n1)OCCO2

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 4/20 0.51
HIF1A Q16665 3/20 0.51
LMNA P02545 2/20 0.51
ADRB2 P07550 7/20 0.44
CYP2D6 P10635 1/20 0.38
NFKB1 P19838 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 1/20 0.37
BLM P54132 1/20 0.37
ADRB3 P13945 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
SCHEMBL22864191 0.85 ADRB1 (0.35) ADRB1HIF1ALMNAADRB2CYP2D6
SCHEMBL23311674 0.80 AOC3 (0.37) LMNACASP7
SCHEMBL24630901 0.80 HIF1A (0.47) ADRB1HIF1ALMNAADRB2CYP2D6
SCHEMBL21605732 0.78 AOC3 (0.35) CYP3A4
SCHEMBL21603252 0.75 PTGS1 (0.36) CYP2D6CYP3A4CYP2C9
SCHEMBL30134146 0.75 PTGS1 (0.36) CYP2D6CYP3A4CYP2C9
SCHEMBL24630982 0.72 ADRB2 (0.50) ADRB1ADRB2TSHRKMT2AADRB3
SCHEMBL11730637 0.72 HIF1A (0.50) ADRB1HIF1ALMNAADRB2CYP2D6
SCHEMBL23554439 0.71 CYP3A4 (0.36) CYP2D6CYP3A4CYP2C9
SCHEMBL10840859 0.70 HIF1A (0.69) ADRB1HIF1ALMNAADRB2CYP2D6

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 ADRB1 2/4885HIF1A 2371/4885LMNA 1389/4885

“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.