SCHEMBL6422645

SCHEMBL6422645

COc1ccccc1N(CC(=O)N1CCC(CN2CCCCC2)CC1)C(=O)c1ccc2c(C)c[nH]c2c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 4/20 0.39
LMNA P02545 4/20 0.39
F10 P00742 1/20 0.39
KDM2B Q8NHM5 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPY1R P25929 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6424232 0.92 MAPT (0.42) SMN1; SMN2MAPTLMNAF10KDM2B
SCHEMBL6421346 0.89 MAPT (0.40) MAPTLMNAF10GAAMEN1
SCHEMBL6424181 0.89 F10 (0.39) MAPTLMNAF10KDM2BGAA
SCHEMBL6421727 0.87 ACHE (0.41) SMN1; SMN2MAPTLMNAKDM2BPOLB
Hydrochloric Acid SCHEMBL6420510 0.87 F10 (0.43) MAPTLMNAF10GAAALDH1A1
Hydrochloric Acid SCHEMBL6424224 0.86 ACHE (0.41) SMN1; SMN2MAPTLMNAKDM2BPOLB
SCHEMBL6423165 0.84 F10 (0.37) MAPTLMNAF10GAA
SCHEMBL6420537 0.84 PKM (0.38) MAPTLMNAF10KDM2BGAA
SCHEMBL6424049 0.83 ACHE (0.44) SMN1; SMN2MAPTLMNAKDM2BPOLB
SCHEMBL6419879 0.83 MAPT (0.37) MAPTLMNAF10GAA

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 SMN1; SMN2 1756/4885MAPT 4835/4885LMNA 70/4885

“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.