SCHEMBL2071960

SCHEMBL2071960

Cc1cc(NC(=O)C(Nc2ccc3[nH]ccc3c2)c2ccccc2)ccc1N1CCCCC1=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.49
MAPT P10636 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
NOTUM Q6P988 1/20 0.40
ALDH1A1 P00352 4/20 0.39
HTT P42858 1/20 0.39
CHRNA7 P36544 2/20 0.39
ROCK2 O75116 1/20 0.39
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
FAAH O00519 1/20 0.36
NPY1R P25929 1/20 0.36
LMNA P02545 1/20 0.36
EPHX1 P07099 1/20 0.36
CFTR P13569 1/20 0.36
KDM4E B2RXH2 1/20 0.35
POLB P06746 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
SCHEMBL2070889 0.87 F10 (0.48) F10MAPTNPC1RAB9AALDH1A1
SCHEMBL2073617 0.85 F10 (0.48) F10MAPTALDH1A1HTTROCK2
SCHEMBL2071596 0.84 F10 (0.48) F10MAPTNPC1RAB9AALDH1A1
SCHEMBL2073621 0.84 F10 (0.48) F10MAPTRAB9AALDH1A1HTT
SCHEMBL2073687 0.83 F10 (0.49) F10MAPTNPC1RAB9ANOTUM
SCHEMBL2072659 0.83 ROCK2 (0.52) F10NOTUMALDH1A1HTTROCK2
SCHEMBL2070521 0.83 F10 (0.49) F10NOTUMALDH1A1HTTROCK2
SCHEMBL2073782 0.81 F10 (0.51) F10MAPTNPC1RAB9ANOTUM
SCHEMBL2074288 0.81 F10 (0.51) F10MAPTNPC1RAB9AALDH1A1
SCHEMBL5164881 0.81 F10 (0.66) F10MAPTNPC1RAB9AALDH1A1

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 9 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
EP-1414456-A1 PHENYL DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GmbH (DE) 2004-05-06 EP disclosed
WO-2003013531-A1 PHENYL DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GMBH (DE) 2003-02-20 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-20040235828-A1 Phenyl derivatives as factor XA Inhibitors F11, F2, F12 F10 5/4885MAPT 4259/4885NPC1 2046/4885

“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.