SCHEMBL4434744

SCHEMBL4434744

CNC(=O)c1cc2[nH]c(=O)n(C3C[C@H]4CC[C@@H](C3)N4CC(=O)N3CCC(C)(C)CC3)c2cc1F

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLD2 O14939 11/20 0.36
PLD1 Q13393 11/20 0.36
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
CCR3 P51677 3/20 0.35
HSD11B1 P28845 2/20 0.34
KCNH2 Q12809 2/20 0.33
YEATS4 O95619 1/20 0.33
TNKS O95271 1/20 0.33
PARP1 P09874 1/20 0.33
PARP2 Q9UGN5 1/20 0.33

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
SCHEMBL4565985 0.92 CHRM2 (0.36) PLD2PLD1CHRM2CHRM4CHRM5
SCHEMBL4437415 0.88 PLD2 (0.44) PLD2PLD1CHRM2CHRM4CHRM5
Trifluoroacetic Acid SCHEMBL5032180 0.88 CHRM2 (0.33) PLD2PLD1CHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL4437597 0.87 PLD2 (0.44) PLD2PLD1CHRM2CHRM4CHRM5
SCHEMBL5006610 0.86 PLD1 (0.35) PLD2PLD1CHRM2CHRM4CHRM5
SCHEMBL4435740 0.82 PLD1 (0.43) PLD2PLD1KCNH2YEATS4
SCHEMBL4436324 0.81 YEATS4 (0.41) PLD2PLD1CHRM2CHRM4CHRM5
SCHEMBL4445833 0.81 YEATS4 (0.44) PLD2PLD1HSD11B1KCNH2YEATS4
SCHEMBL4436480 0.80 PLD2 (0.40) PLD2PLD1CHRM2CHRM4CHRM5
SCHEMBL5000499 0.79 PLD2 (0.47) PLD2PLD1KCNH2YEATS4

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 6 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
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 PLD2 917/4885PLD1 351/4885CHRM2 3679/4885

“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.