SCHEMBL5629014

SCHEMBL5629014

O=C(CCNC(=O)c1ccc(Cl)cc1)Nc1ccc(-n2ccc(=O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
ALDH1A1 P00352 1/20 0.55
RHOC P08134 2/20 0.54
RHOA P61586 2/20 0.54
LMNA P02545 1/20 0.49
RAB9A P51151 1/20 0.47
MAPT P10636 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HDAC6 Q9UBN7 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL5437504 0.79 RHOC (0.52) POLBALDH1A1RHOCRHOARAB9A
SCHEMBL5629380 0.76 F10 (0.72)
SCHEMBL5566675 0.72 POLB (0.57) POLBALDH1A1RHOCRHOARAB9A
SCHEMBL5569234 0.72 POLB (0.55) POLBALDH1A1RHOCRHOARAB9A
SCHEMBL5570584 0.71 POLB (0.48) POLBALDH1A1RHOCRHOARAB9A
SCHEMBL5567048 0.71 POLB (0.48) POLBALDH1A1RHOCRHOARAB9A
SCHEMBL5570390 0.71 POLB (0.47) POLBALDH1A1RHOCRHOALMNA
SCHEMBL16527560 0.70 IDO1 (0.60) POLBALDH1A1RHOCRHOA
SCHEMBL16542660 0.70 IDO1 (0.60) POLBALDH1A1RHOCRHOA
SCHEMBL1534265 0.70 RHOC (1.00) POLBALDH1A1RHOCRHOA

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-1723164-A1 BETA-AMINOACID-DERIVATIVES AS FACTOR Xa INHIBITORS Sanofi-Aventis Deutschland GmbH (DE) 2006-11-22 EP claimed
WO-2005095440-A1 BETA-AMINOACID-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-10-13 WO claimed
US-20070179122-A1 Beta-Aminoacid-Derivatives As Factor Xa Inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-02 US disclosed
EP-1723164-A1 BETA-AMINOACID-DERIVATIVES AS FACTOR Xa INHIBITORS Sanofi-Aventis Deutschland GmbH (DE) 2006-11-22 EP disclosed
WO-2005095440-A1 BETA-AMINOACID-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-10-13 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-20070179122-A1 Beta-Aminoacid-Derivatives As Factor Xa Inhibitors F12, F11, F5 POLB 609/4885ALDH1A1 2861/4885RHOC 1553/4885

“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.