SCHEMBL3564964

SCHEMBL3564964

CN1CCN=C1c1ccc(NC(=O)[C@@H](CC(=O)OCc2ccccc2)NC(=O)Nc2ccc(Cl)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 4/20 0.48
F10 P00742 6/20 0.42
UTS2R Q9UKP6 1/20 0.40
BCHE P06276 1/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
MMP9 P14780 1/20 0.38
CTSK P43235 1/20 0.38
PPIA P62937 1/20 0.37
EP300 Q09472 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
SCHEMBL3560576 1.00 CCKBR (0.48) CCKBRF10UTS2RBCHEMEN1
SCHEMBL3559100 1.00 CCKBR (0.48) CCKBRF10UTS2RBCHEMEN1
SCHEMBL3566371 0.87 FPR2 (0.45) F10UTS2REP300
SCHEMBL3567334 0.86 UTS2R (0.43) CCKBRF10UTS2RMAPTEP300
SCHEMBL3562613 0.86 F10 (0.46) CCKBRF10UTS2RMEN1MAPT
SCHEMBL3567021 0.86 F10 (0.46) CCKBRF10UTS2RMEN1MAPT
SCHEMBL3562133 0.86 F10 (0.46) CCKBRF10UTS2RMEN1MAPT
SCHEMBL3569445 0.86 MEN1 (0.41) CCKBRF10UTS2RMEN1MAPT
SCHEMBL3563910 0.83 F10 (0.45) CCKBRF10UTS2RMEN1MAPT
SCHEMBL3557895 0.83 F10 (0.44) CCKBRF10UTS2RKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678913-B2 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-03-16 US disclosed
US-7678913-B2 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-03-16 US disclosed
US-20060160821-A1 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2006-07-20 US disclosed
WO-2006063113-A2 UREAS AS FACTOR XA INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2006-06-15 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-20060160821-A1 Ureas as factor Xa inhibitors TFPI, F12, F11 CCKBR 1599/4885F10 9/4885UTS2R 52/4885

“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.