SCHEMBL22817205

SCHEMBL22817205

O[C@H]1CC[C@@H](c2ccc(Cl)c(C3CCC3)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 8/20 0.53
KCNH2 Q12809 3/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
CYP2D6 P10635 2/20 0.41
SLC18A3 Q16572 1/20 0.36
OPRL1 P41146 2/20 0.35
ESR1 P03372 5/20 0.35
ACMSD Q8TDX5 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
SLC5A1 P13866 1/20 0.34
SLC5A2 P31639 1/20 0.34
HRH3 Q9Y5N1 1/20 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
SCHEMBL3790975 0.89 SLC6A2 (0.47) ESR2KCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL3792713 0.86 SLC6A2 (0.51) KCNH2SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL3783984 0.86 SLC6A2 (0.42) KCNH2SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL3787199 0.84 SLC6A2 (0.50) KCNH2SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL22817120 0.80 ESR2 (0.53) ESR2KCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL22817118 0.80 ESR2 (0.53) ESR2KCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL22817121 0.80 ESR2 (0.53) ESR2KCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL3784884 0.74 SLC6A2 (0.47) ESR2KCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL2407 0.74 SLC6A2 (0.65) KCNH2SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL7153005 0.74 ESR2 (0.55) ESR2KCNH2SLC6A2SLC6A4SLC6A3

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-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease BIOMARIN PHARMACEUTICAL INC. (US) 2022-07-12 US disclosed
US-20210171474-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2021-06-10 US disclosed
WO-2020257487-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2020-12-24 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 (2 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-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease XDH, PNPO, AGXT ESR2 4547/4885KCNH2 3420/4885SLC6A2 1708/4885
US-20210171474-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE XDH, PNPO, AGXT ESR2 4547/4885KCNH2 3420/4885SLC6A2 1708/4885

“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.