SCHEMBL5640168

SCHEMBL5640168

O=C(NCC1CC(=O)N(c2ccc(C3(CN4CCCC4)CC3)cc2)C1)c1ccc2[nH]cc(Cl)c2c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.54
F2 P00734 1/20 0.38
CCR3 P51677 1/20 0.36
FPR2 P25090 2/20 0.35
BCHE P06276 1/20 0.34
FPR1 P21462 1/20 0.34
KCNH2 Q12809 1/20 0.34
CACNA1I Q9P0X4 1/20 0.34
PLAT P00750 1/20 0.34
KLKB1 P03952 1/20 0.34

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
SCHEMBL5638897 0.87 F10 (0.39) F10
SCHEMBL5641127 0.85 F10 (0.57) F10
SCHEMBL5642077 0.85 F10 (0.45) F10F2FPR2FPR1
SCHEMBL5639804 0.83 LMNA (0.47) F10F2KCNH2CACNA1I
SCHEMBL5643133 0.83 BCHE (0.43) F10F2CCR3FPR2BCHE
SCHEMBL5640496 0.82 F10 (0.42) F10F2FPR2FPR1
SCHEMBL5644157 0.82 BCHE (0.51) CCR3BCHE
SCHEMBL5641205 0.81 BCHE (0.40) F10F2CCR3FPR2BCHE
SCHEMBL5641293 0.80 F10 (0.37) F10F2FPR2BCHEFPR1
SCHEMBL5638146 0.79 CNR1 (0.46)

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 18/4885F2 1/4885CCR3 3202/4885

“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.