SCHEMBL4449759

SCHEMBL4449759

C#Cc1ccc(NC(=O)N2CC(OC(=O)C3CCCC3)CN2C(=O)Nc2ccc(N3CCOCC3=O)c(Cl)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.45
TSHR P16473 2/20 0.45
ALDH1A1 P00352 1/20 0.45
F10 P00742 13/20 0.41
RAB9A P51151 1/20 0.36
MAPT P10636 3/20 0.35
MAPK1 P28482 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL4446475 0.90 F10 (0.44) HPGDTSHRALDH1A1F10MAPT
SCHEMBL4446691 0.89 F10 (0.45) HPGDTSHRALDH1A1F10
SCHEMBL4446415 0.88 F10 (0.46) HPGDTSHRALDH1A1F10
SCHEMBL4444453 0.86 F10 (0.46) HPGDTSHRALDH1A1F10RAB9A
SCHEMBL4444452 0.86 F10 (0.46) HPGDTSHRALDH1A1F10RAB9A
SCHEMBL4452304 0.86 F10 (0.46) HPGDTSHRALDH1A1F10RAB9A
SCHEMBL4447292 0.85 F10 (0.47) HPGDTSHRALDH1A1F10RAB9A
SCHEMBL4448202 0.80 F10 (0.44) ALDH1A1F10MAPTMEN1KMT2A
SCHEMBL4448108 0.78 F10 (0.46) F10
SCHEMBL4447306 0.76 F10 (0.55) F10MAPTMAPK1HTTLMNA

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-7557102-B2 Pyrazolidine-1,2-dicarboxyldiphenylamide derivatives as coagulation factor Xa inhibitors for the treatment of thromboses MERCK PATENT GMBH (DE) 2009-07-07 US claimed
EP-1608645-B1 PYRAZOLIDINE-1,2-DICARBOXYLDIPHENYLAMIDE DERIVATIVES AS COAGULATION FACTOR XA INHIBITORS FOR THE TREATMENT OF THROMBOSES MERCK PATENT GMBH (DE) 2007-05-02 EP claimed
US-20060183742-A1 Pyrazolidine-1,2-dicarboxyldiphenylamide derivatives as coagulation factor xa inhibitors for the treatment of thromboses MERCK PATENT GMBH (DE) 2006-08-17 US claimed
US-7557102-B2 Pyrazolidine-1,2-dicarboxyldiphenylamide derivatives as coagulation factor Xa inhibitors for the treatment of thromboses MERCK PATENT GMBH (DE) 2009-07-07 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-20060183742-A1 Pyrazolidine-1,2-dicarboxyldiphenylamide derivatives as coagulation factor xa inhibitors for the treatment of thromboses F2, SERPINC1, F12 HPGD 332/4885TSHR 960/4885ALDH1A1 512/4885

“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.