SCHEMBL2073787

SCHEMBL2073787

O=C(Nc1ccc(N2CCCCC2=O)cc1)C(Nc1ccc2ncccc2c1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.63
HPGDS O60760 1/20 0.45
NAMPT P43490 2/20 0.43
PABPC1 P11940 1/20 0.43
KMT2A Q03164 5/20 0.42
MAPT P10636 5/20 0.42
NPC1 O15118 5/20 0.42
MEN1 O00255 3/20 0.42
POLB P06746 1/20 0.42
KDM4E B2RXH2 2/20 0.41
GAA P10253 2/20 0.41
USP2 O75604 1/20 0.41
ESR1 P03372 1/20 0.41
NR4A1 P22736 1/20 0.41
PTK2B Q14289 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GFER P55789 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 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
SCHEMBL2073687 0.87 F10 (0.49) F10NAMPTPABPC1KMT2AMAPT
SCHEMBL6613311 0.86 F10 (0.61) F10HPGDSKMT2AMAPTNPC1
SCHEMBL2072407 0.81 PABPC1 (0.46) F10NAMPTPABPC1KMT2AMAPT
SCHEMBL5164562 0.79 F10 (0.86) F10HPGDSKMT2AMAPTNPC1
SCHEMBL5164857 0.79 F10 (0.74) F10KMT2AMAPTNPC1MEN1
SCHEMBL5167183 0.79 F10 (0.86) F10HPGDSKMT2AMAPTNPC1
SCHEMBL5163307 0.79 F10 (0.74) F10KMT2AMAPTNPC1MEN1
SCHEMBL5166588 0.79 F10 (0.86) F10HPGDSKMT2AMAPTNPC1
SCHEMBL5164649 0.78 F10 (0.85) F10HPGDSKMT2AMAPTNPC1
SCHEMBL5163720 0.78 F10 (0.73) F10KMT2AMAPTNPC1MEN1

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 8 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-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 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 5/4885HPGDS 309/4885NAMPT 2551/4885

“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.