SCHEMBL16100779

SCHEMBL16100779

COc1cc(C)ccc1N=C(C)c1ncccc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 3/20 0.44
HTT P42858 3/20 0.44
MAPK1 P28482 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
HSP90AA1 P07900 2/20 0.44
MMP14 P50281 1/20 0.44
PLAU P00749 2/20 0.38
ACHE P22303 1/20 0.38
NPC1 O15118 3/20 0.37
AGTR1 P30556 1/20 0.37
RAB9A P51151 5/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CREBBP Q92793 1/20 0.36
GAA P10253 3/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36

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
SCHEMBL16101518 0.88 MAPT (0.36) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL17499773 0.86 MEN1 (0.44) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL17499470 0.86 SMN1; SMN2 (0.35) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL17499483 0.85 ACHE (0.39) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL17499278 0.85 KMT2A (0.44) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL16097187 0.84 HTT (0.41) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL17499626 0.82 RAB9A (0.50) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL17499170 0.78 KMT2A (0.36) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL16097770 0.76 MAPT (0.42) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL16097772 0.76 MAPT (0.42) MAPTMEN1KMT2ASMN1; SMN2KDM4E

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