SCHEMBL16098729

SCHEMBL16098729

COc1cc(C)ccc1N=Cc1cnccn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
CYP1B1 Q16678 1/20 0.40
ACHE P22303 1/20 0.38
ALPL P05186 2/20 0.36
MAPT P10636 5/20 0.35
GAA P10253 4/20 0.35
CTH P32929 1/20 0.35
MEN1 O00255 2/20 0.34
HTT P42858 2/20 0.34
KMT2A Q03164 2/20 0.34
HSP90AA1 P07900 1/20 0.34
MAPK1 P28482 1/20 0.34
MMP14 P50281 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 3/20 0.33
POLB P06746 1/20 0.33
LCK P06239 2/20 0.33
CSF1R P07333 1/20 0.33
HPGD P15428 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
SCHEMBL16098727 1.00 KDM4E (0.43) KDM4ECYP1B1ACHEALPLMAPT
SCHEMBL16097485 0.89 KDM4E (0.45) KDM4EACHEALPLMAPTGAA
SCHEMBL16097484 0.89 KDM4E (0.45) KDM4EACHEALPLMAPTGAA
SCHEMBL16096362 0.88 KDM4E (0.34) KDM4EMAPTGAACTHMEN1
SCHEMBL16096364 0.88 KDM4E (0.34) KDM4EMAPTGAACTHMEN1
SCHEMBL17499392 0.86 KDM4E (0.33) KDM4EGAACTH
SCHEMBL28040282 0.85 KDM4E (0.33) KDM4EGAACTH
SCHEMBL16096547 0.82 NR4A1 (0.47) KDM4ECYP1B1ACHEMAPTGAA
SCHEMBL16096549 0.82 NR4A1 (0.47) KDM4ECYP1B1ACHEMAPTGAA
SCHEMBL16097085 0.82 L3MBTL1 (0.41) KDM4EMAPTGAACTHMEN1

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