SCHEMBL8680598

SCHEMBL8680598

CCC1(C)c2ccccc2N(C)C12C=Cc1cc(OC)cc([N+](=O)[O-])c1O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.41
GAA P10253 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
RECQL P46063 4/20 0.41
LMNA P02545 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
THRB P10828 3/20 0.41
PLIN1 O60240 1/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
PLIN5 Q00G26 1/20 0.41
ABHD5 Q8WTS1 1/20 0.41
MAPK1 P28482 3/20 0.39
NPSR1 Q6W5P4 2/20 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

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
SCHEMBL8680308 0.90 MAPT (0.40) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL7681567 0.89 MAPT (0.49) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL8679960 0.89 SMN1; SMN2 (0.49) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL8679954 0.85 MAPT (0.39) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL8680507 0.84 MAPT (0.38) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL8680080 0.82 MAPT (0.47) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL8680219 0.81 SMN1; SMN2 (0.34) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL8679958 0.81 MEN1 (0.47) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL8680767 0.80 TDP1 (0.33) MAPTGAASMN1; SMN2MEN1KMT2A
SCHEMBL8679997 0.80 MEN1 (0.55) MAPTGAASMN1; SMN2MEN1KMT2A

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