SCHEMBL8685254

SCHEMBL8685254

C1=C(c2ccccc2)C2(Oc3ccc4ccccc4c31)Oc1ccc3ccccc3c1C=C2c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HTT P42858 1/20 0.38
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
CYP1A1 P04798 4/20 0.36
CYP1A2 P05177 4/20 0.36
CYP1B1 Q16678 3/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36

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
SCHEMBL8680213 0.82 KDM4E (0.45) APPALDH1A1MAPTKDM4EHPGD
SCHEMBL8680420 0.78 KDM4E (0.39) APPALDH1A1MAPTKDM4EHPGD
SCHEMBL8680942 0.76 KDM4E (0.36) APPALDH1A1MAPTKDM4EHPGD
SCHEMBL8680702 0.76 ALDH1A1 (0.40) APPALDH1A1MAPTKDM4EHPGD
SCHEMBL8680556 0.72 KDM4E (0.44) APPALDH1A1MAPTKDM4EHPGD
SCHEMBL8680763 0.72 KDM4E (0.38) APPALDH1A1MAPTKDM4EHPGD
SCHEMBL8684846 0.72 KDM4E (0.38) APPALDH1A1MAPTKDM4EHPGD
SCHEMBL8680314 0.70 KDM4E (0.40) ALDH1A1MAPTKDM4EHPGDNPC1
SCHEMBL30284180 0.70 DHFR (0.37) APPALDH1A1MAPTKDM4EHPGD
SCHEMBL8684877 0.69 MEN1 (0.46) ALDH1A1MAPTMEN1KMT2AHTT

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