SCHEMBL5787933

SCHEMBL5787933

[c]1nocc1-c1ccnc2ccsc12

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
PDPK1 O15530 1/20 0.32
PARP1 P09874 1/20 0.32
ACVR1 Q04771 2/20 0.31
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
USP7 Q93009 1/20 0.30

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
SCHEMBL4773518 0.69 ADORA2A (0.39) AXLMKNK1MKNK2PDPK1PARP1
SCHEMBL2733130 0.68 PDPK1 (0.38) PDPK1ADORA2AADORA1
SCHEMBL25156828 0.66 KDR (0.38) AXLMKNK1MKNK2PDPK1PARP1
SCHEMBL104668 0.65 AXL (0.53) AXLMKNK1MKNK2PDPK1PARP1
SCHEMBL29365402 0.65 AXL (0.53) AXLMKNK1MKNK2PDPK1PARP1
SCHEMBL23716941 0.65 PDK1 (0.47) AXLMKNK1MKNK2PDPK1PARP1
SCHEMBL23716942 0.64 CCNB2 (0.43) AXLMKNK1MKNK2PDPK1PARP1
SCHEMBL4037241 0.62 AXL (0.44) AXLMKNK1MKNK2PDPK1PARP1
SCHEMBL31324910 0.62 AXL (0.44) AXLMKNK1MKNK2PDPK1PARP1
SCHEMBL21393430 0.62 AXL (0.44) AXLMKNK1MKNK2PDPK1PARP1

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-20060142612-A1 Arylsulfonamide derivatives MERCK SHARP & DOHME CORP. 2006-06-29 US claimed
EP-1643960-A2 ARYLSULFONAMIDE DERIVATIVES Merck & Co., Inc. (US) 2006-04-12 EP claimed
WO-2005004810-A2 ARYLSULFONAMIDE DERIVATIVES MERCK & CO., INC. (US) 2005-01-20 WO claimed

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-20060142612-A1 Arylsulfonamide derivatives BDKRB1, BDKRB2, LTB4R2 AXL 2161/4885MKNK1 1042/4885MKNK2 1027/4885

“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.