SCHEMBL4472986

SCHEMBL4472986

CSCC(OC(=O)Nc1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
UTS2R Q9UKP6 5/20 0.46
ALDH1A1 P00352 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ATM Q13315 1/20 0.43
KLK7 P49862 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
EPHX2 P34913 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL8320803 1.00 MAPT (0.52) MAPTUTS2RALDH1A1KMT2AMEN1
SCHEMBL1406054 1.00 MAPT (0.52) MAPTUTS2RALDH1A1KMT2AMEN1
SCHEMBL7310030 0.83 MAPT (0.56) MAPTUTS2RALDH1A1KMT2AL3MBTL1
SCHEMBL14078395 0.82 MEN1 (0.39) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL6379411 0.77 MAPT (0.58) MAPTUTS2RALDH1A1CYP1A2CYP2D6
SCHEMBL9335595 0.75 HPGD (0.67) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL1405960 0.74 FPR2 (0.58) MAPTUTS2RALDH1A1ATM
SCHEMBL4475766 0.74 FPR2 (0.58) MAPTUTS2RALDH1A1ATM
SCHEMBL13677845 0.74 FPR2 (0.58) MAPTUTS2RALDH1A1ATM
SCHEMBL6373216 0.73 MAPT (0.50) MAPTUTS2RALDH1A1ATMKLK7

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-7598241-B2 2-[3-(4-chlorophenyl)ureido] N-[4-(2-oxo-2H-pyridin-1-yl)phenyl]-4-methanesulfonylbutyramide; prophylaxis and/or therapy of thromboembolic diseases and for the treatment of tumors MERCK PATENT GMBH (DE) 2009-10-06 US disclosed
US-20060074072-A1 Carboxamide derivatives and their use as factor xa inhibitors MERCK PATENT GMBH (DE) 2006-04-06 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-20060074072-A1 Carboxamide derivatives and their use as factor xa inhibitors F11, F12, F10 MAPT 4666/4885UTS2R 995/4885ALDH1A1 2219/4885

“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.