SCHEMBL16675201

SCHEMBL16675201

CC(C)(C)c1ccc(C(=O)Nc2cc(NC(=O)c3ccc(C(C)(C)C)cc3)nc(NC(=O)c3ccc(C(C)(C)C)cc3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.56
RAB9A P51151 5/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
TP53 P04637 3/20 0.56
MAPT P10636 2/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
DEGS1 O15121 1/20 0.56
RECQL P46063 1/20 0.55
MAP3K5 Q99683 5/20 0.53
KMT2A Q03164 2/20 0.53
F2 P00734 1/20 0.53
HDAC1 Q13547 1/20 0.51
HDAC3 O15379 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
KCNK9 Q9NPC2 1/20 0.51
TRPV1 Q8NER1 2/20 0.51

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
SCHEMBL821420 0.94 NPC1 (0.51) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL822363 0.91 KMT2A (0.56) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL16284803 0.91 DEGS1 (0.55) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL821800 0.87 SMN1; SMN2 (0.57) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL15305762 0.86 KCNK9 (0.56) NPC1RAB9AMAPTRECQLMAP3K5
SCHEMBL15305765 0.86 KCNK9 (0.56) NPC1RAB9AMAPTRECQLMAP3K5
SCHEMBL17810124 0.84 KCNK3 (0.61) NPC1RAB9ATP53MAP3K5KMT2A
SCHEMBL17810125 0.84 KCNK3 (0.61) NPC1RAB9ATP53MAP3K5KMT2A
SCHEMBL15305759 0.82 KCNK3 (0.62) NPC1RAB9AMAPTRECQLMAP3K5
SCHEMBL15305756 0.82 KCNK3 (0.62) NPC1RAB9AMAPTRECQLMAP3K5

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-20150114257-A1 METHOD OF PREPARING RETARDATION FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY Konica Minolta, Inc. (JP) 2015-04-30 US disclosed
US-20150114257-A1 METHOD OF PREPARING RETARDATION FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY Konica Minolta, Inc. (JP) 2015-04-30 US disclosed