SCHEMBL25153003

SCHEMBL25153003

CO[C@H](CN)Cc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.57
LTA4H P09960 3/20 0.56
MAOA P21397 2/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
LAP3 P28838 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
BCHE P06276 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
PTGS1 P23219 1/20 0.49
SLC6A2 P23975 1/20 0.49
CYP2C19 P33261 1/20 0.49
PTGS2 P35354 1/20 0.49
SLC6A3 Q01959 1/20 0.49

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
SCHEMBL2554330 0.85 TAAR1 (0.48) MAOALAP3SIGMAR1SLC6A2SLC6A3
SCHEMBL9546973 0.85 TAAR1 (0.48) MAOALAP3SIGMAR1SLC6A2SLC6A3
SCHEMBL7427457 0.84 MAOB (0.53) MAOBLTA4HMAOAGAAMAPT
SCHEMBL11440388 0.81 MAOB (0.60) MAOBLTA4HMAOAGAAMAPT
SCHEMBL4701244 0.80 LTA4H (0.74) MAOBLTA4HMAOAGAAMAPT
SCHEMBL4405219 0.79 SLC6A4 (0.58) MAOBCYP1A2CYP2C19
SCHEMBL25152953 0.78 MAOB (0.60) MAOBLTA4HMAOAGAAMAPT
SCHEMBL29162424 0.78 MAOB (0.60) MAOBLTA4HMAOAGAAMAPT
SCHEMBL2750285 0.78 LTA4H (0.67) MAOBLTA4HMAOAGAAMAPT
SCHEMBL12532788 0.78 LTA4H (0.67) MAOBLTA4HMAOAGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12168648-B2 Opioid receptor modulators EPIODYNE, INC. (US) 2024-12-17 US disclosed
US-20240092746-A1 OPIOID RECEPTOR MODULATORS EPIODYNE, INC. 2024-03-21 US disclosed
EP-4320105-A1 OPIOID RECEPTOR MODULATORS Epiodyne, Inc. (US) 2024-02-14 EP disclosed
US-11634396-B2 Opioid receptor modulators EPIODYNE, INC. (US) 2023-04-25 US disclosed
US-11634396-B2 Opioid receptor modulators EPIODYNE, INC. (US) 2023-04-25 US disclosed
US-20220356157-A1 OPIOID RECEPTOR MODULATORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-11-10 US disclosed
WO-2022216750-A1 OPIOID RECEPTOR MODULATORS EPIODYNE, INC. (US) 2022-10-13 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 (4 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-20240092746-A1 OPIOID RECEPTOR MODULATORS OPRM1, OPRK1, OPRL1 MAOB 523/4885LTA4H 2381/4885MAOA 503/4885
US-12168648-B2 Opioid receptor modulators OPRM1, OPRK1, OPRL1 MAOB 523/4885LTA4H 2381/4885MAOA 503/4885
US-11634396-B2 Opioid receptor modulators OPRM1, OPRK1, OPRL1 MAOB 523/4885LTA4H 2381/4885MAOA 503/4885
US-20220356157-A1 OPIOID RECEPTOR MODULATORS OPRM1, OPRK1, OPRL1 MAOB 523/4885LTA4H 2381/4885MAOA 503/4885

“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.