SCHEMBL15069064

SCHEMBL15069064

Cc1ccc2nc(-c3cc4cc(F)c(N5CCNCC5)cc4oc3=O)cn2c1.O=c1oc2cc(N3CCNCC3)cc(F)c2cc1-c1nc2ccccc2o1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
NPC1 O15118 7/20 0.37
RAB9A P51151 7/20 0.37
MAPT P10636 6/20 0.37
POLB P06746 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
KDM4E B2RXH2 5/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
TP53 P04637 3/20 0.36
HPGD P15428 2/20 0.36
CASP1 P29466 2/20 0.36
HSD17B10 Q99714 2/20 0.36
PKM P14618 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
CASP7 P55210 1/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 2/20 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
SCHEMBL15086380 0.85 SUV39H2 (0.44) ALDH1A1NPC1RAB9AMAPTPOLB
SCHEMBL16669572 0.84 NPC1 (0.45) ALDH1A1NPC1RAB9AMAPTPOLB
SCHEMBL15086175 0.81 KDM4E (0.51) ALDH1A1NPC1RAB9AMAPTKDM4E
SCHEMBL16674774 0.77 ALDH1A1 (0.43) ALDH1A1NPC1RAB9AMAPTPOLB
SCHEMBL15069200 0.76 SUV39H2 (0.37) ALDH1A1NPC1RAB9AMAPTPOLB
SCHEMBL15065827 0.75 RAB9A (0.55) ALDH1A1NPC1RAB9AMAPTPOLB
SCHEMBL15069043 0.75 PIK3CD (0.40) ALDH1A1NPC1RAB9AMAPTPOLB
SCHEMBL15069070 0.75 NPC1 (0.47) ALDH1A1NPC1RAB9AMAPTPOLB
SCHEMBL16669726 0.72 NPC1 (0.45) ALDH1A1NPC1RAB9AMAPTPOLB
SCHEMBL15066661 0.72 SUV39H2 (0.46) ALDH1A1NPC1RAB9ASMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015095449-A1 METHODS FOR MODULATING THE AMOUNT RNA TRANSCRIPTS PTC THERAPEUTICS, INC. (US) 2015-06-25 WO claimed
EP-2797592-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC Therapeutics, Inc. (US) 2014-11-05 EP claimed
WO-2013101974-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS, INC. (US) 2013-07-04 WO claimed
WO-2015095449-A1 METHODS FOR MODULATING THE AMOUNT RNA TRANSCRIPTS PTC THERAPEUTICS, INC. (US) 2015-06-25 WO disclosed