SCHEMBL16101693

SCHEMBL16101693

COc1ccccc1C(C)N=Cc1ccnn1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.36
LMNA P02545 1/20 0.36
MET P08581 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP19A1 P11511 1/20 0.34
PDE10A Q9Y233 1/20 0.33
AMY1A P0DUB6 1/20 0.33
MAPT P10636 1/20 0.32
ALDH1A2 O94788 1/20 0.32
ALDH1A3 P47895 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
ACHE P22303 1/20 0.32
RAB9A P51151 2/20 0.32
CA12 O43570 1/20 0.32

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
SCHEMBL16101827 0.90 SMN1; SMN2 (0.35) SMN1; SMN2LMNAMETKMT2A
SCHEMBL16101895 0.87 LMNA (0.34) SMN1; SMN2LMNAMET
SCHEMBL17499333 0.77 IDO1 (0.36) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL17499723 0.76 ALDH1A1 (0.46) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL17499727 0.76 ALDH1A1 (0.46) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL16099267 0.76 RAB9A (0.38) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL16099266 0.76 RAB9A (0.38) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL17499111 0.75 TDP1 (0.38) SMN1; SMN2ALDH1A1KMT2AMEN1KDM4E
SCHEMBL16096393 0.75 MET (0.36) SMN1; SMN2METALDH1A1KMT2AMEN1
SCHEMBL16095999 0.74 ROCK2 (0.43) SMN1; SMN2LMNAALDH1A1KDM4EHPGD

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