SCHEMBL7301203

SCHEMBL7301203

CC(C)(C)c1ccc(NC(=O)c2ccc(N)cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.76
KMT2A Q03164 2/20 0.76
LMNA P02545 1/20 0.76
POLB P06746 1/20 0.76
PKM P14618 1/20 0.76
APEX1 P27695 1/20 0.76
TDP1 Q9NUW8 1/20 0.76
HDAC3 O15379 2/20 0.73
HDAC6 Q9UBN7 2/20 0.73
HDAC11 Q96DB2 1/20 0.73
HDAC8 Q9BY41 1/20 0.73
TRPV1 Q8NER1 5/20 0.71
PTGS1 P23219 2/20 0.71
NPC1 O15118 2/20 0.71
RAB9A P51151 2/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
CA1 P00915 1/20 0.68
CA2 P00918 1/20 0.68
NPSR1 Q6W5P4 1/20 0.68
NR1H4 Q96RI1 2/20 0.63

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
SCHEMBL7300203 1.00 MEN1 (0.76) MEN1KMT2ALMNAPOLBPKM
SCHEMBL7303163 0.91 HDAC3 (0.86) MEN1KMT2ALMNAHDAC3HDAC6
SCHEMBL9115945 0.90 POLB (0.76) MEN1KMT2ALMNAPOLBPKM
SCHEMBL15651819 0.88 PTGS1 (0.73) MEN1KMT2ALMNAPOLBPKM
SCHEMBL907217 0.87 EPHX2 (0.60) MEN1KMT2ALMNAPOLBPKM
SCHEMBL9681496 0.87 POLB (1.00) MEN1KMT2ALMNAPOLBPKM
SCHEMBL137276 0.87 POLB (1.00) MEN1KMT2ALMNAPOLBPKM
SCHEMBL30319980 0.87 POLB (1.00) MEN1KMT2ALMNAPOLBPKM
SCHEMBL2128727 0.87 POLB (1.00) MEN1KMT2ALMNAPOLBPKM
SCHEMBL1353478 0.87 POLB (1.00) MEN1KMT2ALMNAPOLBPKM

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-0358118-B1 Phenylamides - process for their preparation as well as a drug containing those compounds BOEHRINGER MANNHEIM GMBH (DE) 1994-03-16 EP disclosed
US-5135949-A Anticoagulants BOEHRINGER MANNHEIM GMBH (DE) 1992-08-04 US disclosed
EP-0358118-A1 Phenylamides - process for their preparation as well as a drug containing those compounds Roche Diagnostics GmbH (DE) 1990-03-14 EP disclosed