SCHEMBL8680700

SCHEMBL8680700

CN1c2ccc(Cl)cc2C(C)(C)C12C=Cc1c(ccc([N+](=O)[O-])c1Cl)O2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
GFER P55789 1/20 0.50
LMNA P02545 6/20 0.41
GAA P10253 3/20 0.41
MAPT P10636 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALPG P10696 1/20 0.41
RECQL P46063 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPK1 P28482 5/20 0.34
TSHR P16473 1/20 0.34
ALDH1A1 P00352 3/20 0.34
POLB P06746 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL8863691 0.89 MEN1 (0.56) KMT2AMEN1GFERLMNAGAA
SCHEMBL8685164 0.85 MEN1 (0.43) KMT2AMEN1GFERLMNAGAA
SCHEMBL8680247 0.85 MEN1 (0.47) KMT2AMEN1GFERLMNAGAA
SCHEMBL8684933 0.82 MEN1 (0.54) KMT2AMEN1GFERLMNAGAA
SCHEMBL4580154 0.81 MEN1 (0.70) KMT2AMEN1GFERLMNAGAA
SCHEMBL8680362 0.81 MEN1 (0.43) KMT2AMEN1GFERLMNAGAA
SCHEMBL8680048 0.81 MEN1 (0.41) KMT2AMEN1GFERLMNAGAA
SCHEMBL8685156 0.80 MEN1 (0.46) KMT2AMEN1GFERLMNAGAA
SCHEMBL8682463 0.80 MEN1 (0.48) KMT2AMEN1GFERLMNAGAA
SCHEMBL8681784 0.80 MEN1 (0.43) KMT2AMEN1GFERLMNAGAA

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