SCHEMBL10135173

SCHEMBL10135173

CC(=O)NC(=O)Nc1sccc1C(N)=O

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.76
MAPK8 P45983 9/20 0.55
MAPK10 P53779 4/20 0.55
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
MAPT P10636 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50
FLT3 P36888 1/20 0.50

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
SCHEMBL5092793 0.86 PTK2 (1.00) PTK2MAPK8MAPK10HTTL3MBTL1
SCHEMBL7056886 0.83 PTK2 (0.70) PTK2MAPK8MAPK10HTTMAPT
SCHEMBL5096597 0.80 PTK2 (0.56) PTK2MAPK8MAPK10HTTMAPT
SCHEMBL1680689 0.79 PTK2 (0.73) PTK2MAPK8MAPK10HTTMAPT
SCHEMBL11946878 0.78 PTK2 (0.71) PTK2MAPK8MAPK10HTTMAPT
SCHEMBL13270043 0.78 PTK2 (0.71) PTK2MAPK8MAPK10HTTMAPT
SCHEMBL23323409 0.76 PTK2 (0.69) PTK2MAPK8MAPK10HTTMAPT
SCHEMBL19494280 0.75 PTK2 (0.68) PTK2MAPK8MAPK10HTTMAPT
SCHEMBL4357584 0.75 PTPN2 (0.74) PTK2MAPK8MAPK10HTTMAPT
SCHEMBL18080772 0.74 PTK2 (0.66) PTK2MAPK8MAPK10HTTMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120035251-A1 THIOPHENE INHIBITORS OF IKK-B SERINE-THREONINE PROTEIN KINASE CHROMA THERAPEUTICS LD. (GB) 2012-02-09 US disclosed
US-20110046210-A1 SUBSTITUTED THIOPENECARBOXAMIDES AS IKK-BETA SERINE-, THREONINE-PROTEIN KINASE INHIBITORS CHROMA THERAPEUTICS LTD. (GB) 2011-02-24 US disclosed
US-20110039920-A1 INHIBITORS OF IKK-BETA SERINE-THERONINE PROTEIN KINASE CHROMA THERAPEUTICS LTD. (GB) 2011-02-17 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 (3 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-20110046210-A1 SUBSTITUTED THIOPENECARBOXAMIDES AS IKK-BETA SERINE-, THREONINE-PROTEIN KINASE INHIBITORS IKBKE, CSNK1A1, CSNK1E PTK2 1455/4885MAPK8 692/4885MAPK10 691/4885
US-20120035251-A1 THIOPHENE INHIBITORS OF IKK-B SERINE-THREONINE PROTEIN KINASE IKBKE, IKBKB, NFKBIA PTK2 741/4885MAPK8 247/4885MAPK10 202/4885
US-20110039920-A1 INHIBITORS OF IKK-BETA SERINE-THERONINE PROTEIN KINASE CSNK1E, PACSIN2, CHUK PTK2 1182/4885MAPK8 2048/4885MAPK10 893/4885

“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.