SCHEMBL10756366

SCHEMBL10756366

COC(=O)c1nn(-c2ccc(Cl)cc2)c(C)cc1=O

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 10/20 0.61
MAPK1 P28482 2/20 0.55
KMT2A Q03164 3/20 0.53
MEN1 O00255 1/20 0.51
PTGS1 P23219 1/20 0.50
PTGS2 P35354 1/20 0.50
ALDH1A1 P00352 2/20 0.48
POLB P06746 1/20 0.48

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
SCHEMBL11344136 0.87 KMT2A (0.56) RIPK1MAPK1KMT2AMEN1ALDH1A1
SCHEMBL10597949 0.86 MAPK1 (0.55) RIPK1MAPK1KMT2AALDH1A1POLB
SCHEMBL11388825 0.86 MAPK1 (0.74) RIPK1MAPK1
SCHEMBL11399512 0.86 ALDH1A1 (0.56) RIPK1MAPK1ALDH1A1
SCHEMBL11353800 0.86 RIPK1 (0.64) RIPK1MAPK1
SCHEMBL10761536 0.85 KMT2A (0.49) RIPK1MAPK1KMT2AMEN1PTGS1
Potassium Ion SCHEMBL2691671 0.85 RIPK1 (0.59) RIPK1MAPK1PTGS2
SCHEMBL10812826 0.85 RIPK1 (0.59) RIPK1MAPK1PTGS2
SCHEMBL11356456 0.85 RIPK1 (0.54) RIPK1MAPK1KMT2AALDH1A1
SCHEMBL122207 0.85 MAPK1 (0.76) RIPK1MAPK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0025498-A2 Process for the preparation of pyridazine derivatives ROHM AND HAAS COMPANY (US) 1981-03-25 EP claimed
US-4661145-A HYDRIDIZATION AGENTS ROHM AND HAAS COMPANY (US) 1987-04-28 US disclosed
US-4345934-A Method of producing hybrid cereal grain seeds by application of 1-aryl-1,4-dihydro-4-oxo(thio)-pyridazines ROHM AND HAAS COMPANY (US) 1982-08-24 US disclosed
EP-0037133-A1 Pyridazinone compounds, process for their preparation, compositions containing them and a method of regulating the growth of plants, increasing the yield of soya bean plants and sterilizing the male anthers of plants, including small grain cereal plants, using them as well as a method of producing F1 hybrid seed SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1981-10-07 EP disclosed
EP-0025498-A2 Process for the preparation of pyridazine derivatives ROHM AND HAAS COMPANY (US) 1981-03-25 EP disclosed