SCHEMBL8680374

SCHEMBL8680374

Brc1ccc2c(c1)C=CC1(C=Cc3c(ccc4ccccc34)O1)O2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37
AHR P35869 2/20 0.35
CYP2A6 P11509 1/20 0.34
HTR2C P28335 1/20 0.34
HIF1A Q16665 1/20 0.33
EPAS1 Q99814 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
SCHEMBL6139999 0.85 ALDH1A1 (0.51) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL30612751 0.85 ALDH1A1 (0.51) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL30612735 0.84 ALDH1A1 (0.55) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL5913910 0.84 ALDH1A1 (0.55) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL8680602 0.84 NPC1 (0.43) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL8684967 0.82 KDM4E (0.35) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL8681961 0.80 ALDH1A1 (0.46) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL30612722 0.80 ALDH1A1 (0.46) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL8680691 0.79 ALDH1A1 (0.48) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL8862536 0.77 ALDH1A1 (0.48) KDM4EMEN1NPC1ALDH1A1LMNA

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