SCHEMBL5640949

SCHEMBL5640949

CN(C(=O)CN1CCCC1)c1ccc(N2CC(CNC(=O)c3cccs3)CC2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.48
TP53 P04637 2/20 0.44
LMNA P02545 2/20 0.44
MAOB P27338 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HTR7 P34969 1/20 0.38
MGLL Q99685 1/20 0.38
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
TSHR P16473 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
SCHEMBL5641361 0.90 F10 (0.39) F10NPC1RAB9A
SCHEMBL5639394 0.85 F10 (0.54) F10
SCHEMBL5639424 0.84 ACKR3 (0.51) F10
SCHEMBL5639898 0.83 F10 (0.49) F10
SCHEMBL5642492 0.82 TP53 (0.45) F10TP53LMNA
SCHEMBL5640463 0.82 CHRNA7 (0.40) F10LMNA
SCHEMBL5642367 0.82 HDAC1 (0.39) F10LMNAHPGDL3MBTL1
SCHEMBL5642348 0.81 BCHE (0.49) MAOBNPC1RAB9A
SCHEMBL4586428 0.81 KCNH2 (0.47) F10TP53LMNANPC1RAB9A
SCHEMBL5641371 0.81 L3MBTL1 (0.38) F10LMNAHPGDL3MBTL1TSHR

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-7199149-B2 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL MYERS SQUIBB COMPANY (US) 2007-04-03 US disclosed
US-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMANY 2005-05-19 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-20050107361-A1 Monocyclic and bicyclic lactams as factor Xa inhibitors F2, F12, SPINT2 F10 18/4885TP53 4214/4885LMNA 774/4885

“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.