SCHEMBL24630968

SCHEMBL24630968

CC(C)(C)NC[C@H](O)c1cccc2ccnnc12

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 5/20 0.50
HIF1A Q16665 4/20 0.50
ADRB1 P08588 3/20 0.50
CYP2D6 P10635 2/20 0.50
NFKB1 P19838 2/20 0.50
BLM P54132 1/20 0.49
LMNA P02545 2/20 0.39
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 1/20 0.37
ADRB3 P13945 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL22864231 0.83 HIF1A (0.52) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL24630971 0.83 HIF1A (0.52) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL22864225 0.80 HIF1A (0.51) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL24630910 0.80 HIF1A (0.51) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL24630909 0.76 ADRB1 (0.62) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL22864228 0.76 ADRB1 (0.62) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL24630957 0.75 ADRB2 (0.47) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL22864043 0.75 ADRB2 (0.47) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL24630960 0.75 ADRB2 (0.52) ADRB2HIF1AADRB1CYP2D6NFKB1
SCHEMBL24631013 0.75 ADRB2 (0.52) ADRB2HIF1AADRB1CYP2D6NFKB1

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 1/4885HIF1A 2371/4885ADRB1 2/4885

“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.