SCHEMBL9828486

SCHEMBL9828486

CCCCOc1cc(CNc2cn[nH]c(=O)c2Br)ccc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
POLB P06746 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPT P10636 2/20 0.47
APAF1 O14727 1/20 0.47
ALDH1A1 P00352 1/20 0.47
PDE4A P27815 2/20 0.44
MAPK1 P28482 2/20 0.44
PDE4D Q08499 2/20 0.44
TNF P01375 1/20 0.44
LMNA P02545 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
NFKB1 P19838 1/20 0.44
GAA P10253 1/20 0.41

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
SCHEMBL9828188 0.97 KMT2A (0.48) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL9828239 0.96 KMT2A (0.47) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL9827490 0.95 KMT2A (0.49) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL8760332 0.91 MAPT (0.57) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL9829304 0.89 KMT2A (0.58) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL9828492 0.88 KMT2A (0.64) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL9827887 0.85 KMT2A (0.63) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL9827437 0.84 POLB (0.62) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL9828399 0.82 KMT2A (0.66) KMT2APOLBKDM4EMAPTAPAF1
SCHEMBL7365755 0.81 POLB (0.45) KMT2APOLBKDM4EMAPTAPAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0201765-B1 3(2H)PYRIDAZINONE, PROCESS FOR ITS PREPARATION AND ANTI-ALLERGIC AGENT CONTAINING IT NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1991-09-18 EP claimed
US-4892947-A 3(2H)Pyridazinone, process for its preparation and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-01-09 US claimed
EP-0201765-A2 3(2H)Pyridazinone, process for its preparation and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1986-11-20 EP claimed