SCHEMBL8680224

SCHEMBL8680224

CN1c2ccc(Cl)cc2C(C)(C)C12C=Cc1cc([N+](=O)[O-])cc(Cl)c1O2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
GFER P55789 1/20 0.51
LMNA P02545 5/20 0.39
GAA P10253 2/20 0.39
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HSD17B10 Q99714 2/20 0.39
ALPG P10696 1/20 0.39
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 6/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HPGD P15428 1/20 0.31
TLR3 O15455 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL4581135 0.91 MEN1 (0.50) MEN1KMT2AGFERLMNAGAA
SCHEMBL8681732 0.91 MEN1 (0.50) MEN1KMT2AGFERLMNAGAA
SCHEMBL8680416 0.90 MEN1 (0.49) MEN1KMT2AGFERLMNAGAA
SCHEMBL8680406 0.90 MEN1 (0.49) MEN1KMT2AGFERLMNAGAA
SCHEMBL8680948 0.88 MAPT (0.52) MEN1KMT2AGFERLMNAGAA
SCHEMBL30612733 0.88 MEN1 (0.48) MEN1KMT2AGFERLMNAGAA
SCHEMBL6140171 0.88 MEN1 (0.48) MEN1KMT2AGFERLMNAGAA
SCHEMBL8680667 0.86 MEN1 (0.49) MEN1KMT2AGFERLMNAGAA
SCHEMBL8684749 0.86 KMT2A (0.46) MEN1KMT2AGFERLMNAGAA
SCHEMBL8680984 0.85 MEN1 (0.47) MEN1KMT2AGFERLMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US claimed
US-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US disclosed
US-5710420-A Method for embedding and recovering machine-readable information XEROX CORPORATION (US) 1998-01-20 US disclosed
US-5633109-A Ink compositions with liposomes containing photochromic compounds XEROX CORPORATION (US) 1997-05-27 US disclosed
US-5593486-A Photochromic hot melt ink compositions XEROX CORPORATION (US) 1997-01-14 US disclosed
US-5551973-A LIQUID CRYSTAL GEL PHASE, MICROEMULSION PHASE XEROX CORPORATION (US) 1996-09-03 US disclosed