SCHEMBL6168826

SCHEMBL6168826

CC(C)(C)OC(=O)c1cc2ccc(NC(=O)c3ccccc3NC(=O)C3CCN(c4ccncc4)CC3)cc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RXFP2 Q8WXD0 1/20 0.46
F10 P00742 17/20 0.44
F2 P00734 4/20 0.42
RXFP1 Q9HBX9 1/20 0.42
ELANE P08246 1/20 0.42

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
SCHEMBL7369945 0.91 F10 (0.44) F10F2ELANE
SCHEMBL7372221 0.91 F10 (0.39) F10F2RXFP1ELANE
SCHEMBL7372754 0.89 F10 (0.42) F10F2ELANE
SCHEMBL7369526 0.89 F10 (0.41) F10F2ELANE
SCHEMBL7374706 0.88 F10 (0.46) F10RXFP1
SCHEMBL7082624 0.82 F10 (0.45) RXFP2F10F2RXFP1ELANE
SCHEMBL6170536 0.82 F10 (0.44) RXFP2F10F2RXFP1ELANE
SCHEMBL6168414 0.81 RXFP2 (0.69) RXFP2F10F2RXFP1ELANE
Hydrochloric Acid SCHEMBL6171321 0.79 HPGD (0.52) RXFP2F10F2RXFP1ELANE
SCHEMBL7372042 0.79 F10 (0.38) F10

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 5 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
EP-1019045-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-03 EP disclosed
EP-1019045-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-19 EP disclosed
WO-1999000128-A9 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 1999-08-05 WO disclosed
WO-1999000128-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed