SCHEMBL22490275

SCHEMBL22490275

COc1ccc(C[C@@H](C)NC[C@H](O)c2cc(Cl)cnc2C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 15/20 0.56
▸ ADRB3 P13945 10/20 0.49
▸ ADRB1 P08588 8/20 0.49
▸ DRD2 P14416 2/20 0.49
▸ SLC2A1 P11166 2/20 0.49
▸ ADRA1A P35348 2/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ CYP2D6 P10635 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ PGR P06401 1/20 0.49
▸ SLC6A4 P31645 1/20 0.49
▸ PTGS2 P35354 1/20 0.49
▸ SLC6A3 Q01959 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ DRD3 P35462 1/20 0.49
▸ GLA P06280 1/20 0.48
▸ ADRA1D P25100 1/20 0.47
▸ ADRA1B P35368 1/20 0.47

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
SCHEMBL22481225 0.87 ADRB2 (0.56) ADRB2ADRB3ADRB1DRD2ADRA1A
SCHEMBL22480917 0.81 ADRB2 (0.56) ADRB2ADRB3ADRB1DRD2ADRA1A
SCHEMBL22481288 0.81 ADRB2 (0.56) ADRB2ADRB3ADRB1DRD2SLC2A1
SCHEMBL22480918 0.78 MEN1 (0.52) ADRB2ADRB3SLC2A1
SCHEMBL22481217 0.77 ADRB2 (0.57) ADRB2ADRB3ADRB1DRD2ADRA1A
SCHEMBL11089904 0.77 ADRB2 (0.59) ADRB2ADRB3ADRB1DRD2SLC2A1
Hydrochloric Acid SCHEMBL11093309 0.76 ADRB2 (0.58) ADRB2ADRB3ADRB1DRD2SLC2A1
SCHEMBL22481289 0.75 ADRB2 (0.63) ADRB2ADRB3ADRB1DRD2SLC2A1
SCHEMBL7151096 0.75 SLC2A1 (0.83) ADRB2ADRB3ADRB1SLC2A1ADRA1A
SCHEMBL7151100 0.75 SLC2A1 (0.83) ADRB2ADRB3ADRB1SLC2A1ADRA1A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230263749-A1 COMPOSITIONS AND METHODS FOR IMPROVING NEUROLOGICAL DISEASES AND DISORDERS CURASEN THERAPEUTICS, INC. 2023-08-24 — — US disclosed
US-20230263749-A1 COMPOSITIONS AND METHODS FOR IMPROVING NEUROLOGICAL DISEASES AND DISORDERS CURASEN THERAPEUTICS, INC. 2023-08-24 — — US disclosed
US-20210371380-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. 2021-12-02 — — US disclosed
US-11040944-B2 Beta adrenergic agonist and methods of using the same CURASEN THERAPEUTICS, INC. (US) 2021-06-22 — — US disclosed
US-10947196-B2 Beta adrenergic agonist and methods of using the same CURASEN THERAPEUTICS, INC. (US) 2021-03-16 — — US disclosed
US-20200308115-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. 2020-10-01 — — 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 (5 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-20200308115-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRB2, ADRB1, ADRA2C ADRB2 1/4885ADRB3 4/4885ADRB1 2/4885
US-10947196-B2 Beta adrenergic agonist and methods of using the same ADRB2, ADRB1, ADRA2C ADRB2 1/4885ADRB3 4/4885ADRB1 2/4885
US-20210371380-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRB2, ADRB1, ADRA2C ADRB2 1/4885ADRB3 4/4885ADRB1 2/4885
US-11040944-B2 Beta adrenergic agonist and methods of using the same ADRB2, ADRB1, ADRA2C ADRB2 1/4885ADRB3 4/4885ADRB1 2/4885
US-20230263749-A1 COMPOSITIONS AND METHODS FOR IMPROVING NEUROLOGICAL DISEASES AND DISORDERS ADRA2A, SNCA, ADRA1A ADRB2 4/4885ADRB3 8/4885ADRB1 5/4885

“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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