SCHEMBL8682012

SCHEMBL8682012

CC1(C)c2ccccc2N(c2ccccc2)C12C=Cc1cc([N+](=O)[O-])ccc1O2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
GFER P55789 1/20 0.56
MAPT P10636 6/20 0.53
GAA P10253 4/20 0.53
NPSR1 Q6W5P4 3/20 0.53
LMNA P02545 3/20 0.53
RECQL P46063 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
ALPG P10696 1/20 0.53
TP53 P04637 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
SMN1; SMN2 Q16637 5/20 0.45
THRB P10828 3/20 0.45
PKM P14618 2/20 0.45
PLIN1 O60240 1/20 0.45
TSHR P16473 1/20 0.45
PLIN5 Q00G26 1/20 0.45
ABHD5 Q8WTS1 1/20 0.45

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
SCHEMBL8682154 0.88 MEN1 (0.48) MEN1KMT2AGFERMAPTGAA
SCHEMBL29466131 0.87 MAPT (0.70) MEN1KMT2AGFERMAPTGAA
SCHEMBL12922324 0.87 MAPT (0.70) MEN1KMT2AGFERMAPTGAA
SCHEMBL79311 0.87 MAPT (0.70) MEN1KMT2AGFERMAPTGAA
SCHEMBL29492998 0.87 MAPT (0.70) MEN1KMT2AGFERMAPTGAA
SCHEMBL12109892 0.86 MEN1 (0.46) MEN1KMT2AGFERMAPTGAA
Hydrochloric Acid SCHEMBL11789208 0.86 MAPT (0.69) MEN1KMT2AGFERMAPTGAA
SCHEMBL12193757 0.85 MAPT (0.58) MEN1KMT2AGFERMAPTGAA
SCHEMBL13359805 0.84 MAPT (0.53) MEN1KMT2AGFERMAPTGAA
SCHEMBL31229272 0.84 MAPT (0.55) MEN1KMT2AGFERMAPTGAA

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 9 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 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
US-4139390-A Presensitized printing plate having a print-out image EASTMAN KODAK COMPANY (US) 1979-02-13 US disclosed
US-4101326-A Process for making stabilized polyesters used in radiation-sensitive compositions for lithographic plates having improved wear life including hindered phenols and phosphoric acid esters EASTMAN KODAK COMPANY (US) 1978-07-18 US disclosed
US-3999989-A SALTS OF INDOLINE SPIROBENZOPYRANS FUJI PHOTO FILM CO., LTD. (JA) 1976-12-28 US disclosed
US-3933509-A Photo-polymerizable composition containing an acid salt of an indolinobenzospiropyran FUJI PHOTO FILM CO., LTD. (JA) 1976-01-20 US disclosed