SCHEMBL7737295

SCHEMBL7737295

CC(C)(C)[Si](C)(C)Oc1cccc2c1CCCN2C(=O)CCl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
GAA P10253 1/20 0.42
ALDH1A1 P00352 3/20 0.42
NOTUM Q6P988 1/20 0.40
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
POLB P06746 1/20 0.37
AKT1 P31749 3/20 0.36
PIK3CD O00329 1/20 0.36
CYP3A4 P08684 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36

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
SCHEMBL13738685 0.77 MEN1 (0.42) KMT2AMEN1ALDH1A1NOTUMDRD2
SCHEMBL27436765 0.74 NOTUM (0.70) KMT2AMEN1LMNAALDH1A1NOTUM
SCHEMBL2487204 0.68 ADRB2 (0.52)
SCHEMBL29588862 0.68 ADRB2 (0.52)
SCHEMBL342522 0.67 SMN1; SMN2 (0.68) KMT2AMEN1GAAALDH1A1NOTUM
SCHEMBL15523743 0.67 NOTUM (0.61) KMT2AMEN1LMNAMAPTNPSR1
SCHEMBL30147617 0.66 UCHL1 (0.61) KMT2AMEN1LMNANOTUMHDAC1
SCHEMBL20571008 0.66 UCHL1 (0.61) KMT2AMEN1LMNANOTUMHDAC1
SCHEMBL2885921 0.66 NOTUM (0.47) KMT2AMEN1LMNAMAPTNPSR1
SCHEMBL25428318 0.66 GAA (0.48) KMT2AMEN1LMNAMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407096-B1 1,4-BENZOTHIAZINE AND 1,4-BENZOXAZINE DERIVATIVES; HYPOTENSIVE, ANTIISCHEMIC, ANTIALLERGEN, ANTIASTHMATIC AND ANTICOAGULANT AGENTS; CARDIOVASCULAR DISORDERS TORAY INDUSTRIES, INC. (JP) 2002-06-18 US disclosed
EP-1028113-A1 FUSED BENZENE HETEROCYCLE DERIVATIVES AND UTILIZATION THEREOF TORAY INDUSTRIES, INC. (JP) 2000-08-16 EP disclosed