SCHEMBL7350811

SCHEMBL7350811

CC(C)(C)OC(=O)N(Cc1cccc(C(=N)NC(=O)OCc2ccccc2)c1)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
BACE1 P56817 6/20 0.44
SYK P43405 1/20 0.43
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PTGES O14684 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
SLC7A5 Q01650 1/20 0.39
IDO1 P14902 1/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
PLAU P00749 1/20 0.38
AKT1 P31749 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL7361249 0.89 HDAC3 (0.47) SMN1; SMN2BACE1SYKMEN1KMT2A
SCHEMBL30386744 0.84 ITGA4 (0.41) SMN1; SMN2BACE1SYKMEN1KMT2A
SCHEMBL25913071 0.81 SLC7A5 (0.42) SMN1; SMN2MEN1KMT2AHDAC3HDAC1
SCHEMBL7944753 0.79 BACE1 (0.46) SMN1; SMN2BACE1SYKMEN1KMT2A
SCHEMBL11893184 0.77 PRSS1 (0.48) SLC7A5
Hydrochloric Acid SCHEMBL15251850 0.76 LOXL2 (0.49)
SCHEMBL7385091 0.76 LOXL2 (0.55) SMN1; SMN2SLC7A5RAB9A
SCHEMBL7498986 0.75 PLAU (0.47) SMN1; SMN2KMT2APPARGPPARAPLAU
SCHEMBL25054127 0.74 SYK (0.55) SYKMEN1KMT2AHDAC3HDAC1
SCHEMBL1680609 0.74 BCHE (0.54) SMN1; SMN2PTGES

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
US-6228854-B1 1-BENZAZEPINE DERIVATIVE ANTICOAGULANTS; STROKE PREVENTION COR THERAPEUTICS, INC. 2001-05-08 US disclosed
EP-0994894-A1 SELECTIVE FACTOR Xa INHIBITORS COR THERAPEUTICS, INC. (US) 2000-04-26 EP disclosed
WO-1999007731-A1 SELECTIVE FACTOR Xa INHIBITORS COR THERAPEUTICS, INC. (US) 1999-02-18 WO disclosed