SCHEMBL8680358

SCHEMBL8680358

CC1(C)c2ccccc2N(c2ccccc2)C12C=Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.47
MAPK1 P28482 3/20 0.47
MEN1 O00255 7/20 0.40
KMT2A Q03164 7/20 0.40
TDP1 Q9NUW8 7/20 0.40
MAPT P10636 5/20 0.40
LMNA P02545 5/20 0.40
NPSR1 Q6W5P4 4/20 0.40
GAA P10253 3/20 0.40
RECQL P46063 2/20 0.40
ALPG P10696 1/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GFER P55789 1/20 0.39
HSP90AA1 P07900 2/20 0.36
TSHR P16473 2/20 0.34
PLIN1 O60240 1/20 0.34
THRB P10828 1/20 0.34
PKM P14618 1/20 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
SCHEMBL14261901 0.91 MAPT (0.39) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL8685202 0.91 MAPT (0.39) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL8680992 0.89 MAPT (0.43) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL5573271 0.88 SMN1; SMN2 (0.55) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL8680930 0.87 MAPT (0.38) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL8679957 0.84 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL8682012 0.84 MEN1 (0.56) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL8862747 0.82 SMN1; SMN2 (0.48) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL8681170 0.82 SMN1; SMN2 (0.46) SMN1; SMN2MAPK1MEN1KMT2ATDP1
SCHEMBL8681025 0.82 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1MEN1KMT2ATDP1

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