SCHEMBL4586509

SCHEMBL4586509

COc1ccc(C(=O)NCC2CC(=O)N(c3ccc(C(C)(C)CN4CCOCC4)cc3)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
LMNA P02545 3/20 0.51
POLB P06746 1/20 0.51
F10 P00742 3/20 0.51
TSHR P16473 1/20 0.47
KDM4E B2RXH2 2/20 0.46
ENPP2 Q13822 3/20 0.45
TDP1 Q9NUW8 1/20 0.44
HIF1A Q16665 1/20 0.43
EPAS1 Q99814 1/20 0.43
TP53 P04637 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GFER P55789 1/20 0.42

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
SCHEMBL5640468 0.91 F10 (0.48) MAPTLMNAPOLBF10KDM4E
SCHEMBL5641350 0.85 F10 (0.52) LMNAF10KDM4EENPP2TP53
SCHEMBL5641859 0.85 F10 (0.41) MAPTLMNAPOLBF10TDP1
SCHEMBL5642199 0.84 MAPT (0.47) MAPTLMNAPOLBF10KDM4E
SCHEMBL4588119 0.84 F10 (0.40) LMNAPOLBF10ENPP2ALDH1A1
SCHEMBL5640091 0.84 PRSS1 (0.43) LMNAPOLBF10ALDH1A1
SCHEMBL5640946 0.82 MAPT (0.46) MAPTLMNAPOLBKDM4ETP53
SCHEMBL5639756 0.79 BCHE (0.50) MAPTPOLB
SCHEMBL5639641 0.79 LMNA (0.57) MAPTLMNAPOLBF10ALDH1A1
SCHEMBL5643104 0.78 BCHE (0.43) MAPTLMNAF10ENPP2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1667647-A4 MONOCYCLIC AND BICYCLIC LACTAMS AS FACTOR XA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2008-10-22 EP disclosed
US-7199149-B2 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL MYERS SQUIBB COMPANY (US) 2007-04-03 US disclosed
EP-1667647-A2 MONOCYCLIC AND BICYCLIC LACTAMS AS FACTOR XA INHIBITORS Bristol-Myers Squibb Company (US) 2006-06-14 EP disclosed
US-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMANY 2005-05-19 US disclosed
WO-2005032468-A2 MONOCYCLIC AND BICYCLIC LACTAMS AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-04-14 WO 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-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors F2, F12, SPINT2 MAPT 4614/4885LMNA 774/4885POLB 4173/4885

“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.