SCHEMBL4445833

SCHEMBL4445833

CNC(=O)c1cc2[nH]c(=O)n(C3CCN(CC(=O)N4CCC5(CCCC5)CC4)CC3)c2cc1F

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
YEATS4 O95619 1/20 0.44
KCNH2 Q12809 1/20 0.44
PLD2 O14939 15/20 0.42
PLD1 Q13393 15/20 0.42
OPRM1 P35372 3/20 0.40
DRD2 P14416 1/20 0.39
HSD11B1 P28845 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
SCHEMBL4435740 0.97 PLD1 (0.43) YEATS4KCNH2PLD2PLD1OPRM1
SCHEMBL4437415 0.92 PLD2 (0.44) YEATS4KCNH2PLD2PLD1OPRM1
Hydrochloric Acid SCHEMBL4437597 0.92 PLD2 (0.44) YEATS4KCNH2PLD2PLD1OPRM1
SCHEMBL4436324 0.90 YEATS4 (0.41) YEATS4KCNH2PLD2PLD1OPRM1
SCHEMBL4436480 0.89 PLD2 (0.40) YEATS4KCNH2PLD2PLD1OPRM1
SCHEMBL4437636 0.89 KCNH2 (0.39) YEATS4KCNH2PLD2PLD1OPRM1
SCHEMBL4440924 0.88 YEATS4 (0.40) YEATS4KCNH2PLD2PLD1OPRM1
SCHEMBL4437367 0.88 PLD2 (0.39) YEATS4KCNH2PLD2PLD1OPRM1
SCHEMBL4435656 0.87 YEATS4 (0.39) YEATS4KCNH2PLD2PLD1OPRM1
SCHEMBL4445791 0.87 PLD2 (0.42) YEATS4KCNH2PLD2PLD1OPRM1

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.