SCHEMBL10686259

SCHEMBL10686259

CCCCc1cc(C(=O)OC)ccc1OCCCNc1cnn(C(C)C)c(=O)c1Br

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
MAPK14 Q16539 1/20 0.36
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.34
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
MGLL Q99685 3/20 0.33
LTB4R Q15722 1/20 0.33
PTGER4 P35408 1/20 0.33
PLA2G2D Q9UNK4 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
SMPD1 P17405 3/20 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
SCHEMBL10680579 0.96 MAPK14 (0.36) MTNR1AMTNR1BMAPK14KDM4EMEN1
SCHEMBL10681397 0.92 PLA2G2D (0.41) MTNR1AMTNR1BLTB4RPLA2G2DALDH1A1
SCHEMBL10684523 0.88 PLA2G2D (0.40) KDM4ELTB4RPLA2G2DALDH1A1
SCHEMBL10689346 0.87 PPARA (0.34) MTNR1AMTNR1BNPSR1LTB4RPLA2G2D
SCHEMBL10366527 0.86 KDM4E (0.39) MTNR1AMTNR1BKDM4EMAPTPTGER4
SCHEMBL10682398 0.84 KDM4E (0.43) MTNR1AMTNR1BMAPK14KDM4EMEN1
SCHEMBL10680185 0.84 BPTF (0.40) KDM4EGAATSHRKMT2AHSD17B10
SCHEMBL10368098 0.83 KDM4E (0.43) MTNR1AMTNR1BKDM4ELTB4RPLA2G2D
SCHEMBL10366155 0.82 KDM4E (0.40) MTNR1AMTNR1BKDM4ELTB4RPLA2G2D
SCHEMBL10368185 0.80 PTGER4 (0.41) KDM4EMEN1GAAKMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4783462-A 3(2H)pyridazinone, and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1988-11-08 US claimed
EP-0193853-A2 3(2H)pyridazinone, process for its preparation and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1986-09-10 EP claimed