SCHEMBL6423265

SCHEMBL6423265

Nc1nc(NCC(=O)N2CCC(CN3CCCCC3)CC2)cs1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.42
TP53 P04637 1/20 0.42
THRB P10828 4/20 0.40
LMNA P02545 4/20 0.39
GAA P10253 2/20 0.39
NPY5R Q15761 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL6421723 0.87 MAPT (0.47) MAPTTP53THRBLMNAGAA
SCHEMBL6424028 0.76 MAPT (0.43) MAPTTP53THRBLMNAGAA
SCHEMBL6420791 0.74 MAPT (0.56) MAPTTP53THRBLMNAGAA
SCHEMBL6353752 0.74 SCD (0.46) MAPT
SCHEMBL4832511 0.70 POLB (0.47) THRBLMNAPOLB
SCHEMBL6346320 0.69 RAB9A (0.35)
SCHEMBL7142275 0.69 ACHE (0.41) MAPTTP53THRBLMNAPOLB
Hydrochloric Acid SCHEMBL6420638 0.68 KDM2B (0.40) MAPTTHRBLMNAPOLB
SCHEMBL6423206 0.67 MAPT (0.57) MAPTTP53LMNAGAAPOLB
SCHEMBL4807003 0.67 HSD17B10 (0.51) MAPT

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
EP-1289953-B1 SERINE PROTEASE INHIBITORS LILLY CO ELI (US) 2005-09-07 EP disclosed
US-6784182-B2 AND FACTOR XA INHIBITORS USEFUL IN THE TREATMENT OF CARDIOVASCULAR DISORDERS ELI LILLY AND COMPANY 2004-08-31 US disclosed
US-20020151724-A1 Serine protease inhibitors ELI LILLY AND COMPANY 2002-10-17 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 (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-20020151724-A1 Serine protease inhibitors SERPINE1, PRSS1, SERPINB1 MAPT 4835/4885TP53 4473/4885THRB 4088/4885

“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.