SCHEMBL16101401

SCHEMBL16101401

COc1ccc(C)cc1N=CCc1cnn(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.38
MPI P34949 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CSF1R P07333 1/20 0.35
KDM4E B2RXH2 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
MAPK1 P28482 2/20 0.34
HSP90AA1 P07900 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
MMP14 P50281 1/20 0.34
LRRK2 Q5S007 1/20 0.34
ACHE P22303 1/20 0.34
GAA P10253 2/20 0.34
USP2 O75604 1/20 0.34
PLAU P00749 1/20 0.34
POLB P06746 3/20 0.34

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
SCHEMBL16098555 0.90 PDE4B (0.36) PDE4BKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL16101519 0.88 HPGD (0.31) PDE4BSMN1; SMN2MAPTLRRK2
SCHEMBL16102408 0.87 HPGD (0.31) PDE4BSMN1; SMN2
SCHEMBL28039879 0.86 HPGD (0.30) PDE4BSMN1; SMN2
SCHEMBL17499775 0.84 PDE1A (0.38) PDE4BKMT2AMEN1ALDH1A1CSF1R
SCHEMBL16101392 0.82 HPGD (0.32) SMN1; SMN2MAPT
SCHEMBL16101151 0.80 HPGD (0.31) SMN1; SMN2
SCHEMBL17499407 0.80 MPI (0.38) MPIKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL17499409 0.80 MPI (0.38) MPIKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL28039907 0.79 HPGD (0.30) SMN1; SMN2

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