SCHEMBL9106652

SCHEMBL9106652

CCc1ccc2c(c1)N(C(CC)S(=O)(=O)O)c1ccccc1O2

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 9/20 0.38
PIM1 P11309 1/20 0.37
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
P2RX1 P51575 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 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
SCHEMBL9103970 0.93 P2RX4 (0.38) P2RX4PIM1NPC1ALDH1A1LMNA
SCHEMBL9102651 0.91 HTR2A (0.31) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL9107621 0.91 P2RX4 (0.36) P2RX4PIM1P2RX1HDAC3HDAC6
SCHEMBL9103992 0.89 P2RX4 (0.38) P2RX4PIM1SMN1; SMN2P2RX1HDAC3
SCHEMBL9102530 0.87 MAPT (0.32) P2RX4NPC1ALDH1A1LMNAMAPT
SCHEMBL9106158 0.86 P2RX4 (0.43) P2RX4PIM1MAPTSMN1; SMN2P2RX1
SCHEMBL9102737 0.85 PIM1 (0.52) P2RX4PIM1ALDH1A1MAPT
SCHEMBL9099173 0.85 AHR (0.39) P2RX4PIM1ALDH1A1LMNAMAPT
SCHEMBL9106487 0.85 P2RX4 (0.33) P2RX4PIM1P2RX1
SCHEMBL9103974 0.83 P2RX4 (0.36) P2RX4PIM1MAPTSMN1; SMN2P2RX1

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