SCHEMBL8680281

SCHEMBL8680281

CC1=Cc2cc([N+](=O)[O-])ccc2OC12Sc1ccc(NC(=O)C(C)C)cc1N2C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 2/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 8/20 0.39
MEN1 O00255 7/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
ALDH1A1 P00352 4/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP2D6 P10635 1/20 0.36
CES2 O00748 1/20 0.36
ABCB11 O95342 1/20 0.36
GLA P06280 1/20 0.36
ADORA3 P0DMS8 1/20 0.36

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
SCHEMBL8680299 0.87 POLB (0.34) MAPTPOLBSMN1; SMN2LMNARAB9A
SCHEMBL8680754 0.83 SMN1; SMN2 (0.40) MAPTPOLBGAASMN1; SMN2LMNA
SCHEMBL8678921 0.79 SNCA (0.38) MAPTGAASMN1; SMN2LMNARAB9A
SCHEMBL8680938 0.79 MEN1 (0.38) MAPTPOLBRAB9AKMT2AMEN1
SCHEMBL8680419 0.75 MEN1 (0.36) MAPTLMNARAB9AKMT2AMEN1
SCHEMBL8685181 0.73 SNCA (0.50) MAPTSMN1; SMN2LMNARAB9AKMT2A
SCHEMBL8680463 0.73 MEN1 (0.35) MAPTRAB9AKMT2AMEN1
SCHEMBL8680439 0.73 SNCA (0.40) MAPTSMN1; SMN2LMNAKMT2AMEN1
SCHEMBL8684837 0.71 SNCA (0.36) MAPTGAASMN1; SMN2LMNARAB9A
SCHEMBL8680101 0.70 SNCA (0.37) MAPTGAASMN1; SMN2LMNARAB9A

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