SCHEMBL6170072

SCHEMBL6170072

CC(C)(C)OC(=O)n1ccc2ccc(NC(=O)c3cc(N)ccc3NC(=O)c3ccc(C(C)(C)C)cc3)cc21

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 16/20 0.47
EPHX2 P34913 2/20 0.47
PPARG P37231 6/20 0.44
PPARA Q07869 5/20 0.44
F10 P00742 2/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PPARD Q03181 1/20 0.39
SERPINE1 P05121 1/20 0.39

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
SCHEMBL6168239 0.93 NR1H4 (0.47) NR1H4EPHX2PPARGPPARAMEN1
SCHEMBL6173466 0.88 NR1H4 (0.58) NR1H4EPHX2PPARGPPARAPPARD
SCHEMBL6173478 0.87 F10 (0.47) NR1H4EPHX2PPARGPPARAF10
SCHEMBL6170547 0.86 MAPT (0.48) NR1H4EPHX2PPARGPPARAMEN1
SCHEMBL6170664 0.85 NR1H4 (0.43) NR1H4EPHX2PPARGPPARAF10
SCHEMBL6170028 0.84 NR1H4 (0.43) NR1H4EPHX2PPARGPPARAF10
SCHEMBL6171161 0.82 NR1H4 (0.45) NR1H4EPHX2PPARGPPARAF10
SCHEMBL7083889 0.82 NR1H4 (0.51) NR1H4EPHX2PPARGPPARAPPARD
SCHEMBL6168019 0.81 HPGD (0.50) NR1H4EPHX2PPARGPPARAMEN1
SCHEMBL6169297 0.80 NR1H4 (0.43) NR1H4EPHX2PPARGPPARAMEN1

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-1019045-B1 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2005-06-08 EP disclosed
US-20030078431-A1 Antithrombotic agents BEIGHT DOUGLAS WADE (US) 2003-04-24 US disclosed
US-6500851-B2 ANTICOAGULANT IN MAMMLS ELI LILLY AND COMPANY 2002-12-31 US disclosed
US-20020173518-A1 Antithrombotic agents BEIGHT DOUGLAS WADE (US) 2002-11-21 US disclosed
EP-1019045-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-03 EP disclosed
US-6372759-B1 BLOOD COAGULATION FACTOR XA FOR MAMMALS ELI LILLY AND COMPANY 2002-04-16 US disclosed
EP-1019045-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-19 EP disclosed
WO-1999000128-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 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 (2 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-20020173518-A1 Antithrombotic agents SERPINC1, TFPI, F11 NR1H4 1884/4885EPHX2 445/4885PPARG 3664/4885
US-20030078431-A1 Antithrombotic agents SERPINC1, TFPI, F11 NR1H4 1884/4885EPHX2 445/4885PPARG 3664/4885

“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.