SCHEMBL4884698

SCHEMBL4884698

CS(=O)(=O)c1ccc(-c2noc(CNCCc3ccccc3F)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
KMT2A Q03164 2/20 0.48
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MEN1 O00255 1/20 0.42
EPHX2 P34913 1/20 0.42
HPGD P15428 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
THRB P10828 1/20 0.41
POLB P06746 1/20 0.41
PTGS2 P35354 1/20 0.41
MPO P05164 1/20 0.41

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
SCHEMBL4887739 0.85 NPC1 (0.55) MAPTKMT2ALMNATSHRMEN1
SCHEMBL8469388 0.77 SCN5A (0.46) MAPTKMT2ATSHRCA1CA2
SCHEMBL4888633 0.76 CYP1A2 (0.47) KMT2ALMNAHPGDMPO
SCHEMBL5178277 0.75 NPSR1 (0.43) MAPTKMT2ATSHRSMN1; SMN2POLB
SCHEMBL4885906 0.74 NPC1 (0.53) MAPTTSHRHPGDSMN1; SMN2MPO
SCHEMBL4884701 0.72 SMN1; SMN2 (0.41) MAPTKMT2ALMNATSHRCA1
SCHEMBL4888764 0.71 CTSS (0.43) MAPTKMT2ATSHRPTGS2
SCHEMBL6333408 0.69 TSHR (0.67) MAPTLMNATSHRHPGDSMN1; SMN2
SCHEMBL4891052 0.67 CA9 (0.51) CA1CA2
SCHEMBL20663366 0.66 SIRT2 (0.59) MAPTKMT2ALMNATSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064728-A1 Heterocyclic Compounds Useful as Dpp-Iv Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2008-03-13 US disclosed
EP-1623983-A1 Heterocyclic compounds useful as DPP-IV inhibitors Santhera Pharmaceuticals (Deutschland) Aktiengesellschaft (DE) 2006-02-08 EP 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-20080064728-A1 Heterocyclic Compounds Useful as Dpp-Iv Inhibitors DPP4, DPP7, DPP3 MAPT 4293/4885KMT2A 1218/4885LMNA 3950/4885

“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.