SCHEMBL16100440

SCHEMBL16100440

COc1cccc(C)c1N=C(c1ccccc1)c1cn(C)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
HTT P42858 4/20 0.34
LMNA P02545 4/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
NPSR1 Q6W5P4 3/20 0.34
RAB9A P51151 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
MITF O75030 2/20 0.34
TP53 P04637 2/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
SRC P12931 1/20 0.33
HSD11B1 P28845 1/20 0.33
KDM4A O75164 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
AGTR1 P30556 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL16102710 0.88 LMNA (0.31) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL16101685 0.87
SCHEMBL16096945 0.84 ATP4A (0.32) LMNAMAPTTSHRPOLBATP4A
SCHEMBL16101253 0.83 HTT (0.39) ALDH1A1HTTLMNASMN1; SMN2NPSR1
SCHEMBL16097038 0.81 RAB9A (0.51) ALDH1A1HTTLMNASMN1; SMN2NPSR1
SCHEMBL16102403 0.81 ESR2 (0.36) HTTLMNASMN1; SMN2NPSR1RAB9A
SCHEMBL16097382 0.80 TBXA2R (0.44) ALDH1A1HTTLMNASMN1; SMN2NPSR1
SCHEMBL16104921 0.79 HTT (0.40) ALDH1A1HTTLMNASMN1; SMN2NPSR1
SCHEMBL16096302 0.79 EGLN1 (0.36) ALDH1A1HTTSMN1; SMN2NPSR1RAB9A
SCHEMBL16101628 0.78 KMT2A (0.40) ALDH1A1HTTLMNASMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969593-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORP (JP) 2020-11-04 EP disclosed
US-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed
EP-2969593-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES Bridgestone Corporation (JP) 2016-01-20 EP disclosed
WO-2014149931-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORPORATION (JP) 2014-09-25 WO disclosed