SCHEMBL11114086

SCHEMBL11114086

CC1(C)CCC(C(O)c2cccc(C(F)(F)F)c2)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.43
HSD17B2 P37059 1/20 0.42
SLC6A2 P23975 5/20 0.41
SLC6A4 P31645 3/20 0.41
CES2 O00748 1/20 0.40
HTR2C P28335 2/20 0.39
HTR2B P41595 2/20 0.39
EPHX1 P07099 1/20 0.39
HTR2A P28223 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39
HTR6 P50406 1/20 0.38
HSD11B1 P28845 1/20 0.37
ACP3 P15309 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM3 P20309 1/20 0.37
MRGPRX1 Q96LB2 1/20 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
SCHEMBL29601854 1.00 PNMT (0.43) PNMTHSD17B2SLC6A2SLC6A4CES2
SCHEMBL22443547 0.83 CES2 (0.39) SLC6A2SLC6A4CES2
SCHEMBL22443532 0.83 CES2 (0.39) SLC6A2SLC6A4CES2
SCHEMBL31010947 0.83 CES2 (0.39) SLC6A2SLC6A4CES2
SCHEMBL22443545 0.83 CES2 (0.39) SLC6A2SLC6A4CES2
SCHEMBL22443636 0.83 CES2 (0.39) SLC6A2SLC6A4CES2
SCHEMBL22443731 0.83 CES2 (0.39) SLC6A2SLC6A4CES2
SCHEMBL22443535 0.83 CES2 (0.39) SLC6A2SLC6A4CES2
SCHEMBL22443634 0.83 CES2 (0.39) SLC6A2SLC6A4CES2
SCHEMBL22443536 0.83 CES2 (0.39) SLC6A2SLC6A4CES2

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 8 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 claimed
EP-3941468-A1 HETEROCYCLYL(PHENYL)METHANOL COMPOUNDS USEFUL IN THE TREATMENT OF HYPERGLYCAEMIA Atrogi AB (SE) 2022-01-26 EP claimed
WO-2020188301-A1 HETEROCYCLYL(PHENYL)METHANOL COMPOUNDS USEFUL IN THE TREATMENT OF HYPERGLYCAEMIA ATROGI AB (SE) 2020-09-24 WO claimed
EP-0128120-A2 Trisubstituted oxazolidinones CIBA-GEIGY AG (CH) 1984-12-12 EP claimed
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
EP-0128120-A2 Trisubstituted oxazolidinones CIBA-GEIGY AG (CH) 1984-12-12 EP 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 PNMT 534/4885HSD17B2 484/4885SLC6A2 1338/4885

“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.