SCHEMBL17499773

SCHEMBL17499773

COc1ccccc1N=C(C)c1ncccc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HSP90AA1 P07900 2/20 0.44
NPC1 O15118 2/20 0.44
NSD2 O96028 1/20 0.44
CASP6 P55212 1/20 0.44
PLAU P00749 2/20 0.43
ALDH1A1 P00352 5/20 0.43
MAPT P10636 4/20 0.43
LMNA P02545 2/20 0.43
HSD17B10 Q99714 1/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
GFER P55789 1/20 0.41
HTT P42858 2/20 0.41
NOS3 P29474 2/20 0.40
NOS1 P29475 2/20 0.40
NOS2 P35228 2/20 0.40
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40

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
SCHEMBL17499170 0.86 KMT2A (0.36) MEN1KMT2AHSP90AA1NPC1NSD2
SCHEMBL16100779 0.86 MAPT (0.44) MEN1KMT2AHSP90AA1NPC1NSD2
SCHEMBL17499106 0.85 PLAU (0.34) MEN1KMT2AHSP90AA1NPC1NSD2
SCHEMBL17499817 0.84 ALDH1A1 (0.44) MEN1KMT2AHSP90AA1NPC1NSD2
SCHEMBL16096446 0.82 MEN1 (0.41) MEN1KMT2AHSP90AA1NPC1NSD2
SCHEMBL16095897 0.80 MAPT (0.48) MEN1KMT2AHSP90AA1NPC1NSD2
SCHEMBL16102246 0.79 RAB9A (0.55) MEN1KMT2AHSP90AA1NPC1NSD2
SCHEMBL16101518 0.77 MAPT (0.36) MEN1KMT2AHSP90AA1NPC1PLAU
SCHEMBL16102232 0.76 RAB9A (0.44) MEN1KMT2AHSP90AA1NPC1NSD2
SCHEMBL16102137 0.75 ALDH1A1 (0.41) MEN1KMT2AHSP90AA1NPC1NSD2

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