SCHEMBL2071930

SCHEMBL2071930

Cc1cc(NC(=O)C(Nc2ccc3ncsc3c2)c2ccccc2)ccc1N1CCCCC1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.48
ALDH1A1 P00352 4/20 0.38
UBE2M P61081 1/20 0.38
DCUN1D1 Q96GG9 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 4/20 0.38
RAB9A P51151 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
NPY1R P25929 1/20 0.38
ABCB1 P08183 1/20 0.37
OTUD7B Q6GQQ9 1/20 0.37
USP30 Q70CQ3 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
IRAK4 Q9NWZ3 2/20 0.36
MAP4K1 Q92918 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36

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
SCHEMBL2073782 0.87 F10 (0.51) F10ALDH1A1HTTMAPTRAB9A
SCHEMBL2072667 0.86 F10 (0.50) F10ALDH1A1HTTMAPTRAB9A
SCHEMBL2073687 0.85 F10 (0.49) F10ALDH1A1HTTMAPTRAB9A
SCHEMBL2073621 0.82 F10 (0.48) F10ALDH1A1HTTMAPTRAB9A
SCHEMBL2073617 0.81 F10 (0.48) F10ALDH1A1HTTMAPTKDM4E
SCHEMBL5164881 0.80 F10 (0.66) F10ALDH1A1HTTMAPTRAB9A
SCHEMBL2074288 0.80 F10 (0.51) F10ALDH1A1MAPTRAB9ANPC1
SCHEMBL2071716 0.80 ALDH1A1 (0.53) F10ALDH1A1HTTMAPTRAB9A
SCHEMBL2072659 0.80 ROCK2 (0.52) F10ALDH1A1HTTROCK1
SCHEMBL2070521 0.80 F10 (0.49) F10ALDH1A1HTTROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1414456-B1 PHENYL DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GMBH (DE) 2011-12-28 EP claimed
US-20040235828-A1 Phenyl derivatives as factor XA Inhibitors MERCK PATENTGESELLSCHAFT (DE) 2004-11-25 US claimed
EP-1414456-A1 PHENYL DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GmbH (DE) 2004-05-06 EP claimed
WO-2003013531-A1 PHENYL DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GMBH (DE) 2003-02-20 WO claimed
EP-1414456-B1 PHENYL DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GMBH (DE) 2011-12-28 EP disclosed
US-7902223-B2 For therapy and prophylaxis of thromboses, myocardial infarction, arteriosclerosis, inflammation, apoplexia, angina pectoris, restenosis after angioplasty, claudicatio intermittens, migraine, tumours, tumour diseases and/or tumour metastases MERCK PATENT GMBH (DE) 2011-03-08 US disclosed
US-20040235828-A1 Phenyl derivatives as factor XA Inhibitors MERCK PATENTGESELLSCHAFT (DE) 2004-11-25 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-20040235828-A1 Phenyl derivatives as factor XA Inhibitors F11, F2, F12 F10 5/4885ALDH1A1 1475/4885UBE2M 4212/4885

“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.