SCHEMBL9103943

SCHEMBL9103943

CCCc1cccnc1-c1ccc2c(c1)N(C(CC)S(=O)(=O)O)c1ccccc1O2

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
P2RX4 Q99571 2/20 0.30
P2RX1 P51575 1/20 0.30
APLNR P35414 1/20 0.30
PIM1 P11309 1/20 0.30

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
SCHEMBL9105077 0.95 APLNR (0.34) CHRM1APLNRPIM1
SCHEMBL9103821 0.94
SCHEMBL9102286 0.93 CHRM1 (0.33) CHRM1P2RX4PIM1
SCHEMBL9100327 0.89 APLNR (0.32) APLNR
SCHEMBL9100299 0.88 PDK1 (0.30)
SCHEMBL9102741 0.88 GRIA2 (0.38) P2RX4PIM1
SCHEMBL9103600 0.88 CHRM1 (0.31) CHRM1
SCHEMBL9103559 0.87 P2RX4 (0.31) P2RX4PIM1
SCHEMBL9105801 0.87 PIM1 (0.35) P2RX4PIM1
SCHEMBL9106479 0.84 TP53 (0.32) CHRM1HDAC3HDAC6P2RX4P2RX1

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