SCHEMBL22864291

SCHEMBL22864291

O[C@@H](CNC1CC1)c1ccc(F)c2[nH]ncc12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 10/20 0.40
▸ ADRB1 P08588 7/20 0.40
▸ SLC6A2 P23975 1/20 0.35
▸ ADRA1D P25100 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ ADRA1B P35368 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ SRSF6 Q13247 1/20 0.35
▸ CYP1B1 Q16678 1/20 0.35
▸ TMEM97 Q5BJF2 1/20 0.35
▸ IDO1 P14902 2/20 0.35
▸ HRH1 P35367 1/20 0.35
▸ HRH4 Q9H3N8 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ PRMT5 O14744 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
SCHEMBL24631016 0.95 ADRB2 (0.41) ADRB2ADRB1SLC6A2ADRA1DHTR2A
SCHEMBL22864035 0.80 ADRB1 (0.47) ADRB2ADRB1ADRA1DADRA1AADRA1B
SCHEMBL22864148 0.79 ADRB2 (0.42) ADRB2ADRB1
SCHEMBL29593299 0.79 ADRB2 (0.42) ADRB2ADRB1
SCHEMBL28722151 0.79 ADRB2 (0.42) ADRB2ADRB1
SCHEMBL29593173 0.79 ADRB2 (0.42) ADRB2ADRB1
SCHEMBL22864034 0.79 JAK2 (0.34) ADRB2ADRB1ADRA1AIDO1KDM4E
SCHEMBL22864294 0.78 ADRB2 (0.38) ADRB2ADRB1IDO1
SCHEMBL24631034 0.78 IDO1 (0.59) ADRB2ADRB1IDO1HRH1HRH4
Hydrochloric Acid SCHEMBL29593393 0.78 BLM (0.43) ADRB2ADRB1KDM4E

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-20220315534-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. 2022-10-06 — — US disclosed
WO-2021003161-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. (US) 2021-01-07 — — 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-20220315534-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRB2, ADRB1, ADRA2C ADRB2 1/4885ADRB1 2/4885SLC6A2 55/4885

“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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