SCHEMBL8680992

SCHEMBL8680992

COc1cc2c(c([N+](=O)[O-])c1)OC1(C=C2)N(c2ccccc2)c2ccccc2C1(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.43
SMN1; SMN2 Q16637 7/20 0.43
GAA P10253 4/20 0.43
LMNA P02545 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
RECQL P46063 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
THRB P10828 3/20 0.43
PLIN1 O60240 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
PLIN5 Q00G26 1/20 0.43
ABHD5 Q8WTS1 1/20 0.43
NPSR1 Q6W5P4 3/20 0.38
ALPG P10696 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPK1 P28482 4/20 0.37

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
SCHEMBL8680358 0.89 SMN1; SMN2 (0.47) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL7681567 0.89 MAPT (0.49) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL14261901 0.88 MAPT (0.39) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL8685202 0.88 MAPT (0.39) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL8680930 0.84 MAPT (0.38) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL8680277 0.83 MAPT (0.40) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL8680241 0.82 MEN1 (0.40) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL8680696 0.82 MAPT (0.34) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL8679954 0.81 MAPT (0.39) MAPTSMN1; SMN2GAALMNAMEN1
SCHEMBL8680031 0.81 MAPT (0.44) MAPTSMN1; SMN2GAALMNAMEN1

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