SCHEMBL9102028

SCHEMBL9102028

CCCCc1ccc2c(c1)Oc1ccccc1N2C(CC)S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 7/20 0.38
P2RX1 P51575 1/20 0.38
METAP2 P50579 1/20 0.37
PIM1 P11309 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMPD1 P17405 1/20 0.32
AVPR2 P30518 1/20 0.32
OXTR P30559 1/20 0.32
AVPR1A P37288 1/20 0.32
CA2 P00918 1/20 0.32
TP53 P04637 1/20 0.32
COMT P21964 1/20 0.32

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
SCHEMBL9103992 0.93 P2RX4 (0.38) P2RX4P2RX1METAP2PIM1SMN1; SMN2
SCHEMBL9103974 0.93 P2RX4 (0.36) P2RX4P2RX1METAP2PIM1SMN1; SMN2
SCHEMBL9100247 0.92 METAP2 (0.33) METAP2SMN1; SMN2CA2COMT
SCHEMBL9102584 0.89 METAP2 (0.32) METAP2
SCHEMBL9103970 0.89 P2RX4 (0.38) P2RX4P2RX1METAP2PIM1SMN1; SMN2
SCHEMBL9107621 0.86 P2RX4 (0.36) P2RX4P2RX1METAP2PIM1HDAC3
SCHEMBL9103906 0.85 P2RX4 (0.35) P2RX4P2RX1METAP2PIM1SMN1; SMN2
SCHEMBL9101879 0.85 HTR2A (0.31) METAP2CA2
SCHEMBL9105608 0.84 P2RX4 (0.33) P2RX4P2RX1METAP2PIM1
SCHEMBL9103609 0.82 P2RX4 (0.43) P2RX4P2RX1PIM1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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