SCHEMBL17499484

SCHEMBL17499484

COc1cccc(C)c1/N=C/c1cnccn1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
MAPT P10636 5/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 1/20 0.36
GAA P10253 3/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
MAPK1 P28482 1/20 0.35
CTH P32929 1/20 0.35
CYP19A1 P11511 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
NOTUM Q6P988 1/20 0.34
POLB P06746 1/20 0.33
CYP1A2 P05177 1/20 0.33
AMY1A P0DUB6 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
SCHEMBL17499487 1.00 KDM4E (0.40) KDM4EMAPTL3MBTL1KMT2AMEN1
SCHEMBL5587760 0.87 CTH (0.40) KDM4EKMT2AGAARAB9ANPC1
SCHEMBL5587762 0.87 CTH (0.40) KDM4EKMT2AGAARAB9ANPC1
SCHEMBL16097295 0.87 CTH (0.33) KDM4EMAPTL3MBTL1KMT2AMEN1
SCHEMBL16097296 0.87 CTH (0.33) KDM4EMAPTL3MBTL1KMT2AMEN1
SCHEMBL17499104 0.86 CTH (0.33) KDM4EMAPTL3MBTL1KMT2AMEN1
SCHEMBL5589552 0.86 CTH (0.39) KDM4EKMT2AGAARAB9ANPC1
SCHEMBL28040290 0.85 KDM4E (0.33) KDM4EMAPTL3MBTL1KMT2AMEN1
SCHEMBL16097860 0.83 NR4A1 (0.49) KDM4EMAPTL3MBTL1KMT2AMEN1
SCHEMBL16097858 0.83 NR4A1 (0.49) KDM4EMAPTL3MBTL1KMT2AMEN1

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 3 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