SCHEMBL8680505

SCHEMBL8680505

C1=C2CCCC3=Cc4c(ccc5ccccc45)OC23Oc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
UBE2N P61088 1/20 0.47
KDM4E B2RXH2 3/20 0.36
GLA P06280 2/20 0.36
HPGD P15428 2/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
HSD17B10 Q99714 1/20 0.33
APP P05067 1/20 0.32

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
SCHEMBL8680763 0.92 KDM4E (0.38) MEN1MAPTKMT2ATP53TSHR
SCHEMBL8684846 0.89 KDM4E (0.38) MEN1MAPTKMT2ATP53TSHR
SCHEMBL8682461 0.87 MEN1 (0.33) MEN1MAPTKMT2ATP53TSHR
SCHEMBL8681146 0.84 MEN1 (0.62) MEN1MAPTKMT2ATP53TSHR
SCHEMBL8679953 0.81 TSHR (0.62) MEN1MAPTKMT2ATP53TSHR
SCHEMBL8680636 0.76 MAPT (0.40) MEN1MAPTKMT2ATP53TSHR
SCHEMBL8680702 0.68 ALDH1A1 (0.40) MEN1MAPTKMT2ATSHRMAPK1
SCHEMBL8680285 0.67 MEN1 (0.41) MEN1MAPTKMT2ATP53TSHR
SCHEMBL8680629 0.67 MEN1 (0.46) MEN1MAPTKMT2ATP53TSHR
SCHEMBL8685254 0.66 APP (0.40) MEN1MAPTKMT2ATP53TSHR

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