SCHEMBL22480709

SCHEMBL22480709

CC(C)(C)NC[C@H](O)c1cc(F)cnc1C1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.42
CYP2C9 P11712 2/20 0.42
HTR1A P08908 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
ADRA1A P35348 2/20 0.42
USP2 O75604 1/20 0.42
CYP1A2 P05177 1/20 0.42
ADRA2A P08913 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD1 P21728 1/20 0.42
TBXA2R P21731 1/20 0.42
PTGS1 P23219 1/20 0.42
OPRM1 P35372 1/20 0.42
DRD3 P35462 1/20 0.42
KCNH2 Q12809 1/20 0.42
OPRL1 P41146 3/20 0.38
ADRB2 P07550 5/20 0.38
ADRB1 P08588 3/20 0.37
HIF1A Q16665 2/20 0.37

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
SCHEMBL22481126 0.86 CYP2D6 (0.43) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL22481131 0.86 ADRB2 (0.47) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL22481304 0.82 CYP2D6 (0.40) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL22481336 0.78 ADRB2 (0.44) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL22480686 0.78 CYP2D6 (0.49) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL22481297 0.75 ADRB2 (0.48) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL22481222 0.73 ADRB2 (0.36) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL22480716 0.72 CYP2D6 (0.44) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL22481009 0.72 ADRB2 (0.50) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4
SCHEMBL9641337 0.67 ADRB2 (0.54) CYP2D6CYP2C9HTR1ASLC6A2SLC6A4

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 9 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-20230157974-A1 COMPOSITIONS AND METHODS FOR IMPROVING NEUROLOGICAL DISEASES AND DISORDERS CURASEN THERAPEUTICS, INC. 2023-05-25 US disclosed
US-20220169612-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. 2022-06-02 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
US-20200308114-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 (8 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-20200308114-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRB2, ADRB1, ADRA2C CYP2D6 946/4885CYP2C9 2374/4885HTR1A 154/4885
US-20200308115-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRB2, ADRB1, ADRA2C CYP2D6 946/4885CYP2C9 2374/4885HTR1A 154/4885
US-10947196-B2 Beta adrenergic agonist and methods of using the same ADRB2, ADRB1, ADRA2C CYP2D6 946/4885CYP2C9 2374/4885HTR1A 154/4885
US-20210371380-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRB2, ADRB1, ADRA2C CYP2D6 946/4885CYP2C9 2374/4885HTR1A 154/4885
US-11040944-B2 Beta adrenergic agonist and methods of using the same ADRB2, ADRB1, ADRA2C CYP2D6 946/4885CYP2C9 2374/4885HTR1A 154/4885
US-20220169612-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRA2B, ADRB2, ADRB1 CYP2D6 866/4885CYP2C9 2134/4885HTR1A 147/4885
US-20230263749-A1 COMPOSITIONS AND METHODS FOR IMPROVING NEUROLOGICAL DISEASES AND DISORDERS ADRA2A, SNCA, ADRA1A CYP2D6 3407/4885CYP2C9 4500/4885HTR1A 50/4885
US-20230157974-A1 COMPOSITIONS AND METHODS FOR IMPROVING NEUROLOGICAL DISEASES AND DISORDERS ADRA2A, SNCA, ADRA1A CYP2D6 3407/4885CYP2C9 4500/4885HTR1A 50/4885

“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.