SCHEMBL8680456

SCHEMBL8680456

COc1ccc2c(c1)SC1(Oc3c(cccc3OC)C=C1C)N2C

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.32
MAPT P10636 3/20 0.32
HTT P42858 3/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
SNCA P37840 5/20 0.32
LMNA P02545 2/20 0.32
GAA P10253 2/20 0.31
MAPK1 P28482 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NOX1 Q9Y5S8 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
TSHR P16473 2/20 0.30
MAOA P21397 1/20 0.30
NR1H4 Q96RI1 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL8685181 0.73 SNCA (0.50) SMN1; SMN2MAPTHTTNPC1RAB9A
SCHEMBL8682739 0.72 SMN1; SMN2 (0.33) SMN1; SMN2MAPTHTTNPC1RAB9A
SCHEMBL8680559 0.65 MAPT (0.41) SMN1; SMN2MAPTHTTPOLBLMNA
SCHEMBL8680344 0.65 MAPT (0.44) SMN1; SMN2MAPTHTTPOLBLMNA
SCHEMBL8680938 0.62 MEN1 (0.38) MAPTHTTNPC1POLBRAB9A
SCHEMBL8680641 0.61 MAPK1 (0.40) SMN1; SMN2MAPTPOLBLMNAGAA
SCHEMBL8680215 0.59 MAPT (0.36) SMN1; SMN2MAPTHTTPOLBLMNA
SCHEMBL6102948 0.56 MAPT (0.54) SMN1; SMN2MAPTHTTPOLBLMNA
SCHEMBL7389154 0.55 SNCA (0.81) SMN1; SMN2MAPTHTTNPC1RAB9A
SCHEMBL21753467 0.55 KMT2A (0.43) SMN1; SMN2MAPTHTTNPC1POLB

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