SCHEMBL8250835

SCHEMBL8250835

CN1CCc2ccc(NC(=O)C(CCS)NC(=O)c3ccc(Cl)s3)cc2CC1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.50
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
CCKBR P32239 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
SCHEMBL3032269 0.92 F10 (0.59) F10LMNAMAPK1KMT2ACCKBR
SCHEMBL3031307 0.92 F10 (0.51) F10LMNAMAPK1KMT2ACCKBR
SCHEMBL3023945 0.92 F10 (0.51) F10LMNAMAPK1KMT2ACCKBR
SCHEMBL2571454 0.90 F10 (0.54) F10LMNAMAPK1KMT2ACCKBR
SCHEMBL8252693 0.90 CCKBR (0.51) F10LMNAMAPK1KMT2ACCKBR
SCHEMBL2563403 0.90 F10 (0.49) F10LMNAMAPK1KMT2ACCKBR
SCHEMBL3031666 0.90 F10 (0.58) F10LMNAMAPK1KMT2A
SCHEMBL3023943 0.89 F10 (0.49) F10LMNAMAPK1KMT2A
SCHEMBL3038496 0.88 F10 (0.49) F10LMNAMAPK1KMT2ACCKBR
SCHEMBL3030342 0.88 F10 (0.48) F10LMNAMAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007003536-A1 SUBSTITUTED GLYCINAMIDES HAVING AN ANTITHROMBOTIC AND FACTOR XA-INHIBITING EFFECT BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-01-11 WO disclosed