SCHEMBL4436741

SCHEMBL4436741

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

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLD1 Q13393 1/20 0.43
OPRM1 P35372 5/20 0.39
OPRL1 P41146 5/20 0.39
OPRK1 P41145 4/20 0.39
HSD11B1 P28845 1/20 0.39
KCNH2 Q12809 3/20 0.38
CCR5 P51681 1/20 0.38
SMYD3 Q9H7B4 2/20 0.37
CHRM4 P08173 2/20 0.36
HTR2A P28223 1/20 0.36
HTR7 P34969 1/20 0.36
L3MBTL3 Q96JM7 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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 1.00 PLD1 (0.43) PLD1OPRM1OPRL1OPRK1HSD11B1
Hydrochloric Acid SCHEMBL4439105 0.99 PLD1 (0.42) PLD1OPRM1OPRL1OPRK1HSD11B1
SCHEMBL4443247 0.98 PLD1 (0.43) PLD1OPRM1OPRL1OPRK1HSD11B1
Sulfuric Acid SCHEMBL5006620 0.97 PLD1 (0.41) PLD1OPRM1OPRL1OPRK1HSD11B1
Sulfuric Acid SCHEMBL5006617 0.94 PLD1 (0.39) PLD1OPRM1OPRL1OPRK1HSD11B1
SCHEMBL5000753 0.89 OPRL1 (0.45) PLD1OPRM1OPRL1OPRK1HSD11B1
SCHEMBL4440120 0.89 OPRM1 (0.42) PLD1OPRM1OPRL1OPRK1HSD11B1
SCHEMBL4444348 0.87 OPRL1 (0.47) PLD1OPRM1OPRL1OPRK1HSD11B1
SCHEMBL4446730 0.85 PLD1 (0.43) PLD1OPRM1OPRL1OPRK1HSD11B1
SCHEMBL4436720 0.85 PLD1 (0.43) PLD1OPRM1OPRL1OPRK1HSD11B1

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 10 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
US-20150148387-A1 METHODS OF TREATMENT, DIAGNOSIS AND MONITORING FOR METHAMPHETAMINE TOXICITY WHICH TARGET CERAMIDE METABOLIC PATHWAYS AND CELLULAR SENESCENCE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-05-28 US disclosed
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
US-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER INC 2008-11-20 US 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
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 (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-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE SPTLC1, SPTLC2, CPT1A PLD1 351/4885OPRM1 4069/4885OPRL1 2087/4885
US-20150148387-A1 METHODS OF TREATMENT, DIAGNOSIS AND MONITORING FOR METHAMPHETAMINE TOXICITY WHICH TARGET CERAMIDE METABOLIC PATHWAYS AND CELLULAR SENESCENCE CERS2, CHKB, CES2 PLD1 501/4885OPRM1 2010/4885OPRL1 3073/4885

“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.