SCHEMBL9103992

SCHEMBL9103992

CCCCc1ccc2c(c1)N(C(CC)S(=O)(=O)O)c1ccccc1O2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 7/20 0.38
P2RX1 P51575 1/20 0.38
METAP2 P50579 1/20 0.37
PIM1 P11309 1/20 0.36
HDAC3 O15379 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
TRPV1 Q8NER1 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
SMN1; SMN2 Q16637 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
SCHEMBL9102028 0.93 P2RX4 (0.38) P2RX4P2RX1METAP2PIM1HDAC3
SCHEMBL9107621 0.93 P2RX4 (0.36) P2RX4P2RX1METAP2PIM1HDAC3
SCHEMBL9100247 0.92 METAP2 (0.33) METAP2CA2SMN1; SMN2COMT
SCHEMBL9106652 0.89 P2RX4 (0.38) P2RX4P2RX1PIM1HDAC3HDAC6
SCHEMBL9104818 0.87 METAP2 (0.33) P2RX4P2RX1METAP2
SCHEMBL9103974 0.86 P2RX4 (0.36) P2RX4P2RX1METAP2PIM1HDAC3
SCHEMBL9105608 0.86 P2RX4 (0.33) P2RX4P2RX1METAP2PIM1
SCHEMBL9101879 0.85 HTR2A (0.31) METAP2CA2
SCHEMBL9547674 0.83 METAP2 (0.31) METAP2
SCHEMBL9103906 0.83 P2RX4 (0.35) P2RX4P2RX1METAP2PIM1SMN1; SMN2

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