SCHEMBL8680343

SCHEMBL8680343

CCCCCC1=Cc2cc(C)ccc2OC12C=Cc1ccc3ccccc3c1O2

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.32
TRPA1 O75762 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
CYP2B6 P20813 1/20 0.32
CNR1 P21554 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2A P28223 1/20 0.32
SLC6A4 P31645 1/20 0.32
OPRM1 P35372 1/20 0.32
CYP2J2 P51589 1/20 0.32
CYP1B1 Q16678 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
TRPV3 Q8NET8 1/20 0.32
TRPV4 Q9HBA0 1/20 0.32
TRPV2 Q9Y5S1 1/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL8680616 0.90 NPSR1 (0.32) MAPT
SCHEMBL8682135 0.89 ADRA1D (0.34) CNR1MAPT
SCHEMBL8682757 0.89 KDM4E (0.34) CNR2CYP1A2CNR1MAPT
SCHEMBL8680123 0.88 MAPT (0.35) CNR2TRPA1CYP1A1CYP1A2CYP2A6
SCHEMBL8680037 0.88 ADRA1D (0.36) CNR1MAPT
SCHEMBL8680192 0.88 TDP1 (0.35) CNR2HTR2AMAPT
SCHEMBL8680637 0.86 KDM4E (0.32) CYP1A2CNR1MAPT
SCHEMBL8680624 0.86 CNR2 (0.33) CNR2CNR1MAPT
SCHEMBL8680917 0.85 KDM4E (0.37) CYP1A2CNR1MAPT
SCHEMBL8680043 0.85 CNR1 (0.37) CNR2TRPA1CYP1A1CYP1A2CYP2A6

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 5 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 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