SCHEMBL7098554

SCHEMBL7098554

O=C(O)Oc1cccc2sc3ccccc3c(=O)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50
MAOA P21397 3/20 0.47
MAOB P27338 3/20 0.47
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 2/20 0.43
POLB P06746 2/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 2/20 0.41
KDM4E B2RXH2 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL8096279 0.89 MAPT (0.51) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL914221 0.87 MAPT (0.52) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL10934171 0.87 NPC1 (0.49) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL28165639 0.87 MAPT (0.49) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL11368089 0.85 NPC1 (0.48) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL10788212 0.84 NPC1 (0.53) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL29264291 0.84 MAPT (0.47) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL10498726 0.83 MAOA (0.49) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL28027775 0.83 NPC1 (0.46) MAPTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL8091142 0.82 MAPT (0.56) MAPTNPC1RAB9ACYP1A2CYP3A4

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
EP-0883346-B1 PESTICIDE CONTAINING A PHOTOSENSITIZER AND AN ATTRACTANT DPC D O O (SI) 2003-09-10 EP disclosed
US-6410567-B1 PORPHYRIN; PLANT INSECTICIDE Jori, Guilio (IT) 2002-06-25 US disclosed
EP-0167489-B1 LIQUID THIOXANTHONCARBOXILIC-ACID ESTERS CIBA-GEIGY AG (CH) 1989-01-25 EP disclosed
EP-0127574-B1 LIGHT CROSS-LINKABLE COMPOSITION CIBA-GEIGY AG (CH) 1987-10-07 EP disclosed
EP-0167489-A2 Liquid thioxanthoncarboxilic-acid esters CIBA-GEIGY AG (CH) 1986-01-08 EP disclosed
EP-0033721-B1 POLYMERS CROSS-LINKABLE BY LIGHT WITH PENDING THIOXANTHONE AND IMIDYL GROUPS, AND PROCESS FOR PREPARING SAME CIBA-GEIGY AG (CH) 1985-08-14 EP disclosed
EP-0033720-B1 ESTERS, THIOESTERS AND AMIDES OF THIOXANTHONE CARBONXYLIC ACID, THEIR USE AS SENSITIZERS OR PHOTO INITIATORS AND POLYMERS CIBA-GEIGY AG (CH) 1984-03-07 EP disclosed
EP-0033721-A1 Polymers cross-linkable by light with pending thioxanthone and imidyl groups, and process for preparing same CIBA-GEIGY AG (CH) 1981-08-12 EP disclosed
EP-0033720-A1 Esters, thioesters and amides of thioxanthone carbonxylic acid, their use as sensitizers or photo initiators and polymers CIBA-GEIGY AG (CH) 1981-08-12 EP disclosed