SCHEMBL16677948

SCHEMBL16677948

COC(=O)Oc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(OC(=O)OC)cc3)cc(C(=O)Nc3ccc(OC(=O)OC)cc3)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.59
RAB9A P51151 7/20 0.59
TP53 P04637 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
ALOX15 P16050 1/20 0.59
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
TAS1R3 Q7RTX0 1/20 0.55
TAS1R1 Q7RTX1 1/20 0.55
TAS1R2 Q8TE23 1/20 0.55
ALOX5 P09917 1/20 0.52
TOP1 P11387 2/20 0.51
CASP3 P42574 2/20 0.51
SENP7 Q9BQF6 2/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
ALDH1A1 P00352 4/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 1/20 0.50
GAA P10253 1/20 0.50

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
SCHEMBL16675162 0.91 NPC1 (0.61) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL16681522 0.85 PGR (0.63) NPC1RAB9ATP53SMN1; SMN2KMT2A
SCHEMBL16681524 0.84 TOP1 (0.66) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL2917029 0.84 NPC1 (0.82) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL16677947 0.83 ELANE (0.57) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL16675168 0.80 NPC1 (0.49) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL5235403 0.80 SMN1; SMN2 (0.66) NPC1RAB9ATP53SMN1; SMN2KMT2A
SCHEMBL16681259 0.80 KMT2A (0.67) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL16677852 0.80 PGR (0.60) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL16677946 0.79 LMNA (0.72) NPC1RAB9ATP53SMN1; SMN2ALOX15

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
WO-2016190105-A1 POLYIMIDE FILM, METHOD FOR PRODUCING POLYIMIDE FILM, FLEXIBLE PRINTED BOARD, SUBSTRATE FOR FLEXIBLE DISPLAYS, FRONT PLATE FOR FLEXIBLE DISPLAYS, LED LIGHTING DEVICE AND ORGANIC ELECTROLUMINESCENT DISPLAY DEVICE コニカミノルタ株式会社 2016-12-01 WO disclosed
US-20150114257-A1 METHOD OF PREPARING RETARDATION FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY Konica Minolta, Inc. (JP) 2015-04-30 US disclosed