SCHEMBL16097302

SCHEMBL16097302

COc1cc(C)ccc1N=CCc1nccc(C)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.35
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 2/20 0.33
KMT2A Q03164 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
HSP90AA1 P07900 1/20 0.33
HTT P42858 1/20 0.33
MMP14 P50281 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SYK P43405 1/20 0.33
AURKB Q96GD4 1/20 0.33
INCENP Q9NQS7 1/20 0.33
ALDH1A1 P00352 3/20 0.33
POLB P06746 2/20 0.33
HPGD P15428 2/20 0.33
USP2 O75604 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX12 P18054 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
SCHEMBL16096383 0.89 CA2 (0.30)
SCHEMBL16096423 0.87 MAPT (0.40) ACHEKDM4EMEN1MAPTMAPK1
SCHEMBL16096529 0.87
SCHEMBL16097300 0.85 MAPT (0.36) KDM4EMEN1MAPTKMT2AHSP90AA1
SCHEMBL16096997 0.78 CYP1B1 (0.40) ACHEKDM4EMEN1MAPTMAPK1
SCHEMBL16096995 0.78 CYP1B1 (0.40) ACHEKDM4EMEN1MAPTMAPK1
SCHEMBL17499734 0.78 NPSR1 (0.32) SMN1; SMN2NPSR1
SCHEMBL16095925 0.77 ACHE (0.37) ACHEKDM4EMEN1MAPTMAPK1
SCHEMBL16095750 0.76 MAPT (0.45) ACHEKDM4EMEN1MAPTMAPK1
SCHEMBL16096558 0.76 PKM (0.46) KDM4EMEN1MAPTMAPK1KMT2A

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