SCHEMBL8784355

SCHEMBL8784355

O=c1cc(Cl)cnn1Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.53
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
RECQL P46063 1/20 0.49
HSD17B10 Q99714 2/20 0.47
ALDH1A1 P00352 7/20 0.47
HTT P42858 4/20 0.47
NPSR1 Q6W5P4 4/20 0.47
HPGD P15428 3/20 0.47
KDM4E B2RXH2 3/20 0.47
TSHR P16473 2/20 0.47
KDM4A O75164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NPBWR1 P48145 1/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 4/20 0.44
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44

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
SCHEMBL18980126 0.82 MEN1 (0.61) MEN1KMT2AALDH1A1HTTNPSR1
SCHEMBL23121958 0.82 TSHR (0.39) PTGS1MEN1KMT2AHSD17B10ALDH1A1
SCHEMBL19286604 0.81 TSHR (0.53) PTGS1RECQLHSD17B10ALDH1A1HTT
SCHEMBL1691731 0.81 PTGS1 (0.52) PTGS1MEN1KMT2ARECQLHSD17B10
SCHEMBL8783376 0.81 PTGS1 (0.56) PTGS1MEN1KMT2ARECQLHSD17B10
SCHEMBL17582636 0.80 PTGS1 (0.54) PTGS1MEN1KMT2ARECQLHSD17B10
SCHEMBL26915733 0.80 NPBWR1 (0.60) NPBWR1MAPTPKM
SCHEMBL20443987 0.78 PTGS1 (0.49) PTGS1RECQLHSD17B10ALDH1A1HTT
SCHEMBL19746474 0.78 PTGS1 (0.49) PTGS1MEN1KMT2ARECQLHSD17B10
SCHEMBL17595809 0.78 PTGS1 (0.52) PTGS1MEN1KMT2ARECQLHSD17B10

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
CN-1040829-C Pyridazinone derivatives and compositions for controlling and/or preventing insect pests NISSAN CHEMICAL IND LTD (JP) 1998-11-25 CN disclosed
EP-0398293-B1 Pyridazinone derivatives and compositions for controlling and/or preventing insect pests NISSAN CHEMICAL IND LTD (JP) 1997-08-13 EP disclosed
US-5278163-A Insecticides, pesticides NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1994-01-11 US disclosed
EP-0398293-A1 Pyridazinone derivatives and compositions for controlling and/or preventing insect pests NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-11-22 EP disclosed