SCHEMBL4435207

SCHEMBL4435207

COC(=O)c1cc(N)c(NC2CC3CCC(C2)N3Cc2ccccc2)cc1F

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.50
OPRK1 P41145 4/20 0.50
OPRM1 P35372 3/20 0.50
OPRD1 P41143 1/20 0.50
DRD2 P14416 2/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
LTA4H P09960 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.45

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
SCHEMBL4433054 0.85 OPRM1 (0.45) KCNH2OPRK1OPRM1OPRD1KMT2A
SCHEMBL23970709 0.77 ROCK2 (0.51)
SCHEMBL30850093 0.77 ROCK2 (0.51)
SCHEMBL6017233 0.77 MEN1 (0.54) KCNH2OPRK1OPRM1OPRD1DRD2
SCHEMBL6017229 0.75 KCNH2 (0.60) KCNH2OPRK1OPRM1OPRD1KMT2A
SCHEMBL3527134 0.74 ROCK2 (0.59) KCNH2OPRK1OPRM1OPRD1KMT2A
SCHEMBL4435694 0.73 CCR3 (0.44) KCNH2OPRK1OPRM1KMT2AMEN1
SCHEMBL14146462 0.73 KDM4E (0.39) KCNH2OPRK1OPRD1DRD2KMT2A
SCHEMBL10171732 0.72 CHEK1 (0.75) LTA4H
SCHEMBL617846 0.72 CHEK1 (0.75) LTA4H

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 5 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 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

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 KCNH2 4650/4885OPRK1 2840/4885OPRM1 4069/4885

“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.