SCHEMBL6912476

SCHEMBL6912476

CC(=Nc1ccccc1)c1cc(C)cc(C(C)=Nc2c(C)cccc2C)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 3/20 0.37
NOS3 P29474 2/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
HSP90AA1 P07900 1/20 0.37
ATM Q13315 1/20 0.37
GRIN2D O15399 2/20 0.35
GRIN3B O60391 2/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2A Q12879 2/20 0.35
GRIN2B Q13224 2/20 0.35
GRIN2C Q14957 2/20 0.35
GRIN3A Q8TCU5 2/20 0.35
SIGMAR1 Q99720 2/20 0.35
CYP2D6 P10635 1/20 0.34
HIF1A Q16665 1/20 0.34
CRHR1 P34998 3/20 0.34
MAPT P10636 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.34

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
SCHEMBL6912474 1.00 NOS1 (0.37) NOS1NOS3MEN1KMT2AHSP90AA1
SCHEMBL6916499 0.91 MEN1 (0.39) NOS1MEN1KMT2AHSP90AA1ATM
SCHEMBL6916492 0.91 MEN1 (0.39) NOS1MEN1KMT2AHSP90AA1ATM
SCHEMBL6911321 0.89 NOS3 (0.40) NOS1NOS3MEN1KMT2AHSP90AA1
SCHEMBL6911324 0.89 NOS3 (0.40) NOS1NOS3MEN1KMT2AHSP90AA1
Hydrochloric Acid SCHEMBL7176315 0.88 MEN1 (0.37) MEN1KMT2AHSP90AA1ATMGRIN2D
Hydrochloric Acid SCHEMBL7181518 0.88 MEN1 (0.37) MEN1KMT2AHSP90AA1ATMGRIN2D
Hydrochloric Acid SCHEMBL7176057 0.88 MEN1 (0.37) MEN1KMT2AHSP90AA1ATMGRIN2D
Hydrochloric Acid SCHEMBL7182116 0.88 MEN1 (0.37) MEN1KMT2AHSP90AA1ATMGRIN2D
Hydrochloric Acid SCHEMBL7176564 0.88 MEN1 (0.37) MEN1KMT2AHSP90AA1ATMGRIN2D

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004074333-A2 PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-09-02 WO disclosed