SCHEMBL22443565

SCHEMBL22443565

CC1(C)CC[C@H](C(O)c2ccc(F)cc2)N1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.40
HTR2C P28335 2/20 0.40
HTR7 P34969 2/20 0.40
ALDH1A1 P00352 1/20 0.36
CHRNA1 P02708 1/20 0.36
CHRNG P07510 1/20 0.36
CHRNB1 P11230 1/20 0.36
CHRNB2 P17787 1/20 0.36
SLC6A2 P23975 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CHRND Q07001 1/20 0.36
CYP2D6 P10635 1/20 0.35
HTR6 P50406 1/20 0.34
NR3C1 P04150 2/20 0.34

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
SCHEMBL22443659 1.00 HTR2A (0.40) HTR2AHTR2CHTR7ALDH1A1CHRNA1
SCHEMBL22443660 1.00 HTR2A (0.40) HTR2AHTR2CHTR7ALDH1A1CHRNA1
SCHEMBL22443567 1.00 HTR2A (0.40) HTR2AHTR2CHTR7ALDH1A1CHRNA1
SCHEMBL22443561 1.00 HTR2A (0.40) HTR2AHTR2CHTR7ALDH1A1CHRNA1
Hydrochloric Acid SCHEMBL22443574 0.98 HTR2A (0.39) HTR2AHTR2CHTR7ALDH1A1CHRNA1
Hydrochloric Acid SCHEMBL22443822 0.98 HTR2A (0.39) HTR2AHTR2CHTR7ALDH1A1CHRNA1
Hydrochloric Acid SCHEMBL22443572 0.98 HTR2A (0.39) HTR2AHTR2CHTR7ALDH1A1CHRNA1
Hydrochloric Acid SCHEMBL22443569 0.98 HTR2A (0.39) HTR2AHTR2CHTR7ALDH1A1CHRNA1
Hydrochloric Acid SCHEMBL22443820 0.98 HTR2A (0.39) HTR2AHTR2CHTR7ALDH1A1CHRNA1
SCHEMBL22443612 0.86 SLC6A3 (0.39) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220152004-A1 HETEROCYCLYL(PHENYL)METHANOL COMPOUNDS USEFUL IN THE TREATMENT OF HYPERGLYCAEMIA ATROGI AB (SE) 2022-05-19 US disclosed
EP-3941468-A1 HETEROCYCLYL(PHENYL)METHANOL COMPOUNDS USEFUL IN THE TREATMENT OF HYPERGLYCAEMIA Atrogi AB (SE) 2022-01-26 EP disclosed
WO-2020188301-A1 HETEROCYCLYL(PHENYL)METHANOL COMPOUNDS USEFUL IN THE TREATMENT OF HYPERGLYCAEMIA ATROGI AB (SE) 2020-09-24 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-20220152004-A1 HETEROCYCLYL(PHENYL)METHANOL COMPOUNDS USEFUL IN THE TREATMENT OF HYPERGLYCAEMIA GPR119, SLC5A1, SLC5A2 HTR2A 2445/4885HTR2C 2004/4885HTR7 1697/4885

“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.