SCHEMBL8230680

SCHEMBL8230680

CCCCOC(=O)C(Oc1ccc2c(N)nccc2c1)c1ccc(OC)c(OC)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F2 P00734 8/20 0.45
F12 P00748 3/20 0.45
PLG P00747 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.41
ACHE P22303 1/20 0.41
F7 P08709 13/20 0.39
F3 P13726 13/20 0.39
F10 P00742 8/20 0.39
F11 P03951 3/20 0.39
PRSS1 P07477 2/20 0.39
PRSS2 P07478 2/20 0.39
PRSS3 P35030 2/20 0.39
ROCK1 Q13464 1/20 0.38

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
SCHEMBL12227515 0.85 MRGPRX1 (0.50) F2F12PLGL3MBTL1ACHE
SCHEMBL2543309 0.85 F2 (0.50) F2F12PLGL3MBTL1ACHE
Trifluoroacetic Acid SCHEMBL2539154 0.81 MRGPRX1 (0.46) F2F12PLGACHEF7
SCHEMBL12227512 0.74 F7 (0.61) F2F7F3F10F11
SCHEMBL12227513 0.74 F7 (0.59) F2F7F3F10F11
SCHEMBL2544775 0.73 F7 (0.51) F2F7F3F10F11
SCHEMBL8225873 0.73 F12 (0.48) F2F12PLGROCK1
SCHEMBL2538356 0.72 F7 (0.56) F2F7F3F10F11
SCHEMBL12249919 0.72 F7 (0.51) F2F12PLGF7F3
SCHEMBL2538029 0.72 F7 (0.66) F2F7F3F10F11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044242-B2 2-(aryloxy) acetamide factor VIIa inhibitors useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-25 US disclosed
EP-1856096-B1 PHENYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL MYERS SQUIBB CO (US) 2010-09-01 EP disclosed
US-7622585-B2 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2009-11-24 US disclosed
US-20090131473-A1 2-(ARYLOXY) ACETAMIDE FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY 2009-05-21 US disclosed
WO-2007103996-A1 2-(ARYLOXY)ACETAMIDE FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-09-13 WO disclosed
WO-2006076246-A2 PHENYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-07-20 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-20090131473-A1 2-(ARYLOXY) ACETAMIDE FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS F7, F9, F12 F2 7/4885F12 3/4885PLG 25/4885

“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.