SCHEMBL5000753

SCHEMBL5000753

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

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.45
HSD11B1 P28845 1/20 0.42
PLD1 Q13393 1/20 0.41
KCNH2 Q12809 4/20 0.40
OPRM1 P35372 5/20 0.39
OPRK1 P41145 4/20 0.39
ALDH1A1 P00352 2/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
XIAP P98170 1/20 0.39
BIRC2 Q13490 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CHRM4 P08173 3/20 0.38
KMT2A Q03164 1/20 0.38
CHRM1 P11229 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
SCHEMBL4444348 0.98 OPRL1 (0.47) OPRL1HSD11B1PLD1KCNH2OPRM1
SCHEMBL4438978 0.89 PLD1 (0.43) OPRL1HSD11B1PLD1KCNH2OPRM1
SCHEMBL4436741 0.89 PLD1 (0.43) OPRL1HSD11B1PLD1KCNH2OPRM1
SCHEMBL4440120 0.89 OPRM1 (0.42) OPRL1HSD11B1PLD1KCNH2OPRM1
Hydrochloric Acid SCHEMBL4439105 0.88 PLD1 (0.42) OPRL1HSD11B1PLD1KCNH2OPRM1
SCHEMBL4443247 0.87 PLD1 (0.43) OPRL1HSD11B1PLD1KCNH2OPRM1
Sulfuric Acid SCHEMBL5006620 0.86 PLD1 (0.41) OPRL1HSD11B1PLD1KCNH2OPRM1
SCHEMBL4437940 0.85 OPRL1 (0.45) OPRL1HSD11B1PLD1KCNH2OPRM1
SCHEMBL4435630 0.84 PLD1 (0.36) OPRL1HSD11B1PLD1KCNH2OPRM1
SCHEMBL4432833 0.84 OPRL1 (0.46) OPRL1HSD11B1PLD1KCNH2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER INC 2008-11-20 US claimed
US-20080287479-A1 INHIBITORS OF SERINE PALMITOYLTRANSFERASE PFIZER INC 2008-11-20 US 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 OPRL1 2087/4885HSD11B1 201/4885PLD1 351/4885

“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.