SCHEMBL4436730

SCHEMBL4436730

CNC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCN(CC(=O)N2Cc3ccccc3C2)CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
YEATS4 O95619 2/20 0.52
KCNH2 Q12809 2/20 0.52
PLD2 O14939 16/20 0.51
PLD1 Q13393 15/20 0.51
MLLT3 P42568 1/20 0.50
MLLT1 Q03111 1/20 0.50
YEATS2 Q9ULM3 1/20 0.50
HSD11B1 P28845 1/20 0.48
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL4438969 0.88 YEATS4 (0.53) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL4997111 0.88 YEATS4 (0.49) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL4443230 0.86 YEATS4 (0.56) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL4445651 0.86 YEATS4 (0.53) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL4566119 0.86 YEATS4 (0.59) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL5006589 0.86 PLD2 (0.53) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL4438940 0.85 PLD2 (0.50) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL4440295 0.85 YEATS4 (0.61) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL4440125 0.85 YEATS4 (0.52) YEATS4KCNH2PLD2PLD1MLLT3
SCHEMBL4440717 0.84 YEATS4 (0.55) YEATS4KCNH2PLD2PLD1MLLT3

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 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
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 YEATS4 1467/4885KCNH2 4650/4885PLD2 917/4885

“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.