SCHEMBL4470820

SCHEMBL4470820

NC(=O)c1cccc2sc(N)nc12

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.59
ALDH1A1 P00352 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 1/20 0.54
PDE10A Q9Y233 1/20 0.54
CYP3A4 P08684 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PARP1 P09874 12/20 0.49
PARP2 Q9UGN5 1/20 0.44
PARP3 Q9Y6F1 1/20 0.44
LIMK1 P53667 1/20 0.44

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
SCHEMBL5670201 0.86 PDPK1 (0.59) PDPK1ALDH1A1SMN1; SMN2LMNAPDE10A
Bromide SCHEMBL5669202 0.85 PDPK1 (0.57) PDPK1ALDH1A1SMN1; SMN2LMNAPDE10A
SCHEMBL8583785 0.83 PARP1 (0.49) PARP1PARP2PARP3LIMK1
SCHEMBL30874474 0.81 PARP1 (0.47) PARP1PARP2PARP3
SCHEMBL9722753 0.81 CYP3A4 (0.56) PDPK1ALDH1A1SMN1; SMN2LMNAPDE10A
SCHEMBL23857795 0.79 UBE2T (0.47) ALDH1A1PARP1PARP2PARP3
SCHEMBL2793048 0.77 ALDH1A1 (0.49) PDPK1ALDH1A1SMN1; SMN2LMNAPDE10A
SCHEMBL9722823 0.77 ALDH1A1 (0.53) PDPK1ALDH1A1SMN1; SMN2LMNAPDE10A
SCHEMBL316533 0.75 PARP1 (0.52) ALDH1A1SMN1; SMN2LMNAPARP1
SCHEMBL10726562 0.75 PARP1 (0.45) PARP1PARP2PARP3

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-7553848-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-06-30 US disclosed
EP-1725529-A1 BIS BICYCLIC AMIDES AS VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS OF INFLAMMATORY AND NEUROPATIC PAIN Amgen Inc. (US) 2006-11-29 EP disclosed
WO-2005070885-A1 BIS BICYCLIC AMIDES AS VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS OF INFLAMMATORY AND NEUROPATIC PAIN AMGEN INC. (US) 2005-08-04 WO disclosed
US-20050165046-A1 Vanilloid receptor ligands and their use in treatments AMGEN, INC. 2005-07-28 US 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-20050165046-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 PDPK1 2737/4885ALDH1A1 3014/4885SMN1; SMN2 3132/4885

“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.