SCHEMBL7366762

SCHEMBL7366762

CCS(=O)(=O)c1ccccc1CNC(=O)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.50
DDR1 Q08345 17/20 0.46

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
SCHEMBL7365535 0.87 EPHX2 (0.51) RIPK1DDR1
SCHEMBL8253718 0.81 DDR1 (0.50) DDR1
SCHEMBL5006708 0.79 RIPK1 (0.41) RIPK1
SCHEMBL7366760 0.78 DDR1 (0.40) RIPK1DDR1
SCHEMBL14035784 0.78 L3MBTL1 (0.47) DDR1
SCHEMBL5003176 0.77 RIPK1 (0.39) RIPK1DDR1
SCHEMBL8061739 0.74 TSHR (0.52) RIPK1
SCHEMBL2778215 0.74 RIPK1 (0.46) RIPK1
SCHEMBL7367349 0.73 RIPK1 (0.47) RIPK1DDR1
SCHEMBL16529584 0.73 DDR1 (0.60) DDR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1259506-A1 PYRAZINONE THROMBIN INHIBITORS Merck & Co., Inc. (US) 2002-11-27 EP disclosed
US-6387911-B1 Pyrazinone thrombin inhibitors MERCK & CO., INC. 2002-05-14 US disclosed
WO-2001038323-A1 PYRAZINONE THROMBIN INHIBITORS MERCK & CO., INC. (US) 2001-05-31 WO disclosed