SCHEMBL8680336

SCHEMBL8680336

COc1ccc2c(c1)OC(c1ccccc1)=C(C)C21C=Cc2c(ccc3ccccc23)O1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.36
HTT P42858 3/20 0.36
MTNR1A P48039 1/20 0.36
MAPT P10636 4/20 0.35
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 3/20 0.35
LMNA P02545 3/20 0.35
GAA P10253 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 2/20 0.35
GLA P06280 1/20 0.35
CYP1A2 P05177 5/20 0.34
CYP1A1 P04798 3/20 0.34
CYP1B1 Q16678 3/20 0.34
THRB P10828 3/20 0.33
RECQL P46063 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 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
SCHEMBL8682681 0.93 HTT (0.37) SMN1; SMN2HTTMTNR1AMAPTALDH1A1
SCHEMBL8685140 0.91 HTT (0.36) SMN1; SMN2HTTMTNR1AMAPTALDH1A1
SCHEMBL619662 0.86 MAOB (0.38) SMN1; SMN2HTTMTNR1AMAPTALDH1A1
SCHEMBL8680143 0.85 KDM4E (0.42) SMN1; SMN2HTTMAPTALDH1A1KDM4E
SCHEMBL8680380 0.78 MAOB (0.38) SMN1; SMN2HTTMTNR1AMAPTALDH1A1
SCHEMBL4146942 0.78 MAPT (0.37) SMN1; SMN2HTTMAPTALDH1A1KDM4E
SCHEMBL3929015 0.78 HTT (0.39) SMN1; SMN2HTTMAPTALDH1A1KDM4E
SCHEMBL5182208 0.76 MAPT (0.37) SMN1; SMN2HTTMAPTALDH1A1KDM4E
SCHEMBL29613249 0.76 MAPT (0.37) SMN1; SMN2HTTMAPTALDH1A1KDM4E
SCHEMBL5615321 0.75 SMN1; SMN2 (0.43) SMN1; SMN2HTTMAPTALDH1A1KDM4E

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-5593486-A Photochromic hot melt ink compositions XEROX CORPORATION (US) 1997-01-14 US disclosed