SCHEMBL8680763

SCHEMBL8680763

C1=C2CCCC3=Cc4c(ccc5ccccc45)OC23Oc2ccc3ccccc3c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.38
HPGD P15428 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
GLA P06280 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
HSD17B10 Q99714 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
APP P05067 1/20 0.36
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34

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
SCHEMBL8684846 0.97 KDM4E (0.38) KDM4EHPGDALDH1A1MAPTGLA
SCHEMBL8680505 0.92 MEN1 (0.47) KDM4EHPGDALDH1A1MAPTGLA
SCHEMBL8682461 0.89 MEN1 (0.33) KDM4EHPGDALDH1A1MAPTGLA
SCHEMBL8680702 0.75 ALDH1A1 (0.40) KDM4EHPGDALDH1A1MAPTGLA
SCHEMBL8685254 0.72 APP (0.40) KDM4EHPGDALDH1A1MAPTGLA
SCHEMBL8681146 0.70 MEN1 (0.62) MAPTMEN1KMT2ATSHRTP53
SCHEMBL8680636 0.68 MAPT (0.40) KDM4EHPGDALDH1A1MAPTGLA
SCHEMBL8679953 0.67 TSHR (0.62) MAPTMEN1KMT2ATSHRTP53
SCHEMBL8680124 0.66 NCEH1 (0.43) KDM4EHPGDALDH1A1MAPTGLA
SCHEMBL5913910 0.66 ALDH1A1 (0.55) KDM4EHPGDALDH1A1MAPTGLA

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 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-5551973-A LIQUID CRYSTAL GEL PHASE, MICROEMULSION PHASE XEROX CORPORATION (US) 1996-09-03 US disclosed