SCHEMBL16097772

SCHEMBL16097772

COc1cc(C)ccc1N=Cc1ncccc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.42
KDM4E B2RXH2 5/20 0.42
KMT2A Q03164 5/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
MEN1 O00255 4/20 0.42
HTT P42858 3/20 0.42
MAPK1 P28482 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
HSP90AA1 P07900 1/20 0.42
MMP14 P50281 1/20 0.42
CYP1B1 Q16678 1/20 0.40
ALDH1A1 P00352 6/20 0.39
GAA P10253 4/20 0.39
USP2 O75604 1/20 0.39
CTH P32929 2/20 0.39
POLB P06746 2/20 0.38
ACHE P22303 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.36
TSHR P16473 2/20 0.36
RAB9A P51151 2/20 0.35

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
SCHEMBL16097770 1.00 MAPT (0.42) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL17499706 0.88 KMT2A (0.38) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL17499708 0.88 KMT2A (0.38) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL16097256 0.86 KDM4E (0.36) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL17499322 0.85 ALDH1A1 (0.43) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL16096518 0.85 ALDH1A1 (0.43) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL16096015 0.83 CYP1B1 (0.41) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL16096018 0.83 CYP1B1 (0.41) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL16097632 0.83 CYP1B1 (0.43) MAPTKDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL16097633 0.83 CYP1B1 (0.43) MAPTKDM4EKMT2ASMN1; SMN2MEN1

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