SCHEMBL11158786

SCHEMBL11158786

CCCCC(C(=O)OC)n1c(C)cc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.45
TP53 P04637 3/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
HTT P42858 3/20 0.40
PGR P06401 1/20 0.40
AR P10275 1/20 0.40
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
THRB P10828 1/20 0.38
LMNA P02545 1/20 0.38
NPC1 O15118 1/20 0.38
CYP1A2 P05177 1/20 0.38
HSP90AA1 P07900 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL19347267 0.95 CNR2 (0.46) CNR2TP53TSHRMEN1KMT2A
SCHEMBL7686006 0.79 MCL1 (0.46) CNR2TSHRMEN1KMT2AKDM4E
SCHEMBL11159261 0.78 TP53 (0.38) CNR2TP53TSHRMEN1KMT2A
SCHEMBL19362902 0.77 KMT2A (0.46) CNR2TP53TSHRMEN1KMT2A
SCHEMBL11153091 0.76 CNR2 (0.45) CNR2TP53TSHRMEN1KMT2A
SCHEMBL11152691 0.75 TP53 (0.36) CNR2TP53TSHRMEN1KMT2A
SCHEMBL11159265 0.74 CNR2 (0.41) CNR2TP53TSHRMEN1KMT2A
SCHEMBL7683727 0.74 NOD2 (0.46) CNR2TSHRMEN1KMT2AKDM4E
SCHEMBL11152696 0.73 CNR2 (0.41) CNR2TP53TSHRMEN1KMT2A
SCHEMBL20037197 0.73 MEN1 (0.45) TP53TSHRMEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190232699-A1 PROCESS FOR MANUFACTURING A LASER MARKABLE PACKAGING AGFA NV (BE) 2019-08-01 US disclosed
US-20190232699-A1 PROCESS FOR MANUFACTURING A LASER MARKABLE PACKAGING AGFA NV (BE) 2019-08-01 US disclosed
WO-2017157888-A1 PROCESS FOR MANUFACTURING A LASER MARKABLE PACKAGING AGFA-GEVAERT (BE) 2017-09-21 WO disclosed
WO-2017157888-A1 PROCESS FOR MANUFACTURING A LASER MARKABLE PACKAGING AGFA-GEVAERT (BE) 2017-09-21 WO disclosed
EP-3219503-A1 PROCESS FOR MANUFACTURING A LASER MARKABLE PACKAGING AGFA-GEVAERT (BE) 2017-09-20 EP disclosed
EP-3219503-A1 PROCESS FOR MANUFACTURING A LASER MARKABLE PACKAGING AGFA-GEVAERT (BE) 2017-09-20 EP disclosed
EP-0022634-B1 ACYLATED INDOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS AND DRUGS COMPRISING THEM TEIJIN LIMITED (JP) 1983-04-06 EP disclosed
EP-0022634-A1 Acylated indole derivatives, processes for their preparation and pharmaceutical compositions and drugs comprising them TEIJIN LIMITED (JP) 1981-01-21 EP disclosed