SCHEMBL4440527

SCHEMBL4440527

O=C(CN1CCC(n2c(=O)[nH]c3cc(-c4noc(C(Cl)(Cl)Cl)n4)ccc32)CC1)N1C[C@H]2CCC[C@H]2C1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.42
DRD2 P14416 3/20 0.41
HTR1A P08908 2/20 0.41
HTR2A P28223 2/20 0.41
SLC6A4 P31645 2/20 0.41
DRD3 P35462 2/20 0.41
ADRA2A P08913 1/20 0.41
PLD1 Q13393 7/20 0.41
PLD2 O14939 6/20 0.41
OPRM1 P35372 1/20 0.41
DRD4 P21917 1/20 0.39
HTR7 P34969 1/20 0.39
HRH1 P35367 1/20 0.39
HTR2B P41595 1/20 0.39
AKT1 P31749 2/20 0.39
AKT2 P31751 2/20 0.39
AKT3 Q9Y243 1/20 0.39
CHRM1 P11229 2/20 0.39
HDAC4 P56524 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
SCHEMBL4446518 0.88 CTSS (0.44) CTSSDRD2HTR1AHTR2ASLC6A4
SCHEMBL4438975 0.78 YEATS4 (0.49) DRD2HTR1AHTR2ASLC6A4DRD3
SCHEMBL4435294 0.78 KCNH2 (0.47) DRD2HTR1AHTR2ASLC6A4DRD3
SCHEMBL4446685 0.77 CTSS (0.45) CTSSDRD2HTR1AHTR2ASLC6A4
SCHEMBL4439137 0.77 YEATS4 (0.49) DRD2HTR1AHTR2ASLC6A4DRD3
SCHEMBL4436430 0.76 CTSS (0.44) CTSSDRD2HTR1AHTR2ASLC6A4
SCHEMBL5000703 0.75 PLD2 (0.51) DRD2HTR1AHTR2ASLC6A4DRD3
SCHEMBL4444762 0.74 OPRM1 (0.57) DRD2HTR1AHTR2ASLC6A4DRD3
SCHEMBL5000587 0.72 CTSS (0.55) CTSSDRD2HTR1AHTR2ASLC6A4
SCHEMBL5000682 0.72 HTT (0.43) CTSSDRD2HTR1AHTR2ASLC6A4

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 4 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
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 CTSS 667/4885DRD2 4274/4885HTR1A 2156/4885

“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.