SCHEMBL9103970

SCHEMBL9103970

CCc1ccc2c(c1)Oc1ccccc1N2C(CC)S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 10/20 0.38
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
P2RX1 P51575 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
PIM1 P11309 1/20 0.34
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
METAP2 P50579 1/20 0.33

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
SCHEMBL9106652 0.93 P2RX4 (0.38) P2RX4MAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL9102651 0.91 HTR2A (0.31) MAPTSMN1; SMN2NPC1ALDH1A1LMNA
SCHEMBL9103974 0.91 P2RX4 (0.36) P2RX4MAPTSMN1; SMN2P2RX1NPSR1
SCHEMBL9103479 0.89 NPC1 (0.30) MAPTSMN1; SMN2NPC1ALDH1A1LMNA
SCHEMBL9102028 0.89 P2RX4 (0.38) P2RX4MAPTSMN1; SMN2P2RX1NPSR1
SCHEMBL9103609 0.86 P2RX4 (0.43) P2RX4MAPTSMN1; SMN2LMNAP2RX1
SCHEMBL9101896 0.85 AHR (0.39) P2RX4MAPTSMN1; SMN2ALDH1A1LMNA
SCHEMBL9106573 0.85 PIM1 (0.46) P2RX4PIM1
SCHEMBL9107440 0.85 P2RX4 (0.36) P2RX4MAPTSMN1; SMN2P2RX1NPSR1
SCHEMBL9107621 0.83 P2RX4 (0.36) P2RX4P2RX1HDAC3HDAC6PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3268489-A1 FLUOROGENIC AND CHROMOGENIC SUBSTRATE LI-COR, INC. (US) 2018-01-17 EP disclosed
US-9632034-B2 Fluorogenic and chromogenic substrate LI-COR, INC. (US) 2017-04-25 US disclosed
WO-2016149127-A1 FLUOROGENIC AND CHROMOGENIC SUBSTRATE LI-COR, INC. (US) 2016-09-22 WO disclosed
US-20160266045-A1 FLUOROGENIC AND CHROMOGENIC SUBSTRATE LI-COR, INC. (US) 2016-09-15 US disclosed
US-8192948-B1 Chemifluorescent substrate for peroxide and peroxidase detection PIERCE BIOTECHNOLOGY, INC. (US) 2012-06-05 US disclosed
EP-0361470-B1 Method for the chemiluminescence assay of the activity of peroxidase FUJIREBIO KK (JP) 1993-12-22 EP disclosed
US-5171668-A Measuring light emitted from contacting (iso)luminol, peroxide, peroxidase activity enhancer, such as indoanilines, phenolindophenol and N-methylphenothiazine, with labeled peroxidase antibody-antigen complex FUJIREBIO INC. (JP) 1992-12-15 US disclosed
EP-0361470-A2 Method for the chemiluminescence assay of the activity of peroxidase FUJIREBIO INC. (JP) 1990-04-04 EP disclosed