SCHEMBL7209828

SCHEMBL7209828

O=C(Nc1ccccc1[S])Oc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.54
MEN1 O00255 3/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
TRPV1 Q8NER1 1/20 0.52
ALDH1A1 P00352 8/20 0.51
MAPT P10636 2/20 0.51
CYP1A2 P05177 3/20 0.51
RAD51 Q06609 1/20 0.50
KDM4E B2RXH2 4/20 0.49
GAA P10253 3/20 0.49
HPGD P15428 2/20 0.49
GLA P06280 1/20 0.49
ATM Q13315 1/20 0.49
MAOB P27338 1/20 0.49
HSD17B10 Q99714 1/20 0.48
THRB P10828 1/20 0.47
GFER P55789 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL8177930 0.82 KMT2A (0.71) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL11076373 0.82 KMT2A (0.58) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL8154848 0.80 TRPV1 (0.66) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL1641651 0.80 KMT2A (0.55) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL13462392 0.79 ALDH1A1 (0.55) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL3359614 0.79 KMT2A (0.54) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL7209831 0.79 TP53 (0.56) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL10356846 0.79 RAB9A (0.81) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL3984621 0.79 MEN1 (0.82) KMT2AMEN1NPC1RAB9ANPSR1
SCHEMBL29659875 0.79 ALDH1A1 (0.57) KMT2AMEN1NPC1RAB9ANPSR1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0903350-B1 Pyrrolotriazole derivative FUJI PHOTO FILM CO LTD (JP) 2003-03-12 EP disclosed
EP-0518238-B1 Pyrrolotriazole derivative FUJI PHOTO FILM CO LTD (JP) 1999-04-07 EP disclosed
EP-0903350-A1 Pyrrolotriazole derivative FUJI PHOTO FILM CO., LTD. (JP) 1999-03-24 EP disclosed
US-5837436-A HYDROXYLAMINE COMPOUND AND 3-AMINO-2-PYRAZOLIN-5-ONE DERIVATIVE DEVELOPER; MAGNETIC RECORDING MEDIA; NONFOGGING; COLOR DENSITY; STORAGE STABILITY; HEAT RESISTANCE FUJI PHOTO FILM CO., LTD. (JP) 1998-11-17 US disclosed
US-5508421-A Pyrrolotriazole azomethine dye, and heat transfer dye providing material containing a pyrrolotriazole azomethine dye FUJI PHOTO FILM CO., LTD. (JP) 1996-04-16 US disclosed
US-5362882-A Intermediates for dyes for polyesters, images for heat sensitive elements and electrography FUJI PHOTO FILM CO., LTD. (JP) 1994-11-08 US disclosed
EP-0518238-A1 Pyrrolotriazole derivative FUJI PHOTO FILM CO., LTD. (JP) 1992-12-16 EP disclosed