SCHEMBL4440120

SCHEMBL4440120

O=C(O)c1ccc2c(c1)CC(=O)N2C1CCN(CC(=O)N2C[C@H]3CCC[C@H]3C2)CC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 10/20 0.42
OPRL1 P41146 10/20 0.42
OPRK1 P41145 9/20 0.42
HTR2A P28223 2/20 0.40
HTR7 P34969 2/20 0.40
PLD1 Q13393 1/20 0.39
HSD11B1 P28845 1/20 0.39
KCNH2 Q12809 1/20 0.38
SCN1A P35498 1/20 0.38
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38

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
SCHEMBL4438978 0.89 PLD1 (0.43) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL5000753 0.89 OPRL1 (0.45) OPRM1OPRL1OPRK1PLD1HSD11B1
SCHEMBL4436741 0.89 PLD1 (0.43) OPRM1OPRL1OPRK1HTR2AHTR7
Hydrochloric Acid SCHEMBL4439105 0.88 PLD1 (0.42) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL4444348 0.87 OPRL1 (0.47) OPRM1OPRL1OPRK1PLD1HSD11B1
SCHEMBL4443247 0.87 PLD1 (0.43) OPRM1OPRL1OPRK1HTR2AHTR7
Sulfuric Acid SCHEMBL5006620 0.86 PLD1 (0.41) OPRM1OPRL1OPRK1HTR2AHTR7
Sulfuric Acid SCHEMBL5006617 0.84 PLD1 (0.39) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL4435819 0.83 OPRM1 (0.36) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL5004185 0.76 PLD1 (0.38) OPRM1OPRL1OPRK1HTR2AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121656-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE Pfizer Products Inc. (US) 2009-11-25 EP claimed
US-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER INC 2008-11-20 US claimed
WO-2008084300-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER PRODUCTS INC. (US) 2008-07-17 WO claimed
EP-2121656-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE Pfizer Products Inc. (US) 2009-11-25 EP disclosed
US-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER INC 2008-11-20 US disclosed
WO-2008084300-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER PRODUCTS INC. (US) 2008-07-17 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-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE SPTLC1, SPTLC2, CPT1A OPRM1 4069/4885OPRL1 2087/4885OPRK1 2840/4885

“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.