SCHEMBL9379932

SCHEMBL9379932

O=C1CC(c2cccnc2)=NN1c1nc2ccccc2s1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.64
▸ KMT2A Q03164 6/20 0.64
▸ MAPT P10636 5/20 0.64
▸ POLB P06746 4/20 0.64
▸ LMNA P02545 3/20 0.64
▸ GAA P10253 2/20 0.64
▸ CYP1A2 P05177 1/20 0.62
▸ CYP2D6 P10635 1/20 0.62
▸ CYP2C9 P11712 1/20 0.62
▸ KDM4E B2RXH2 3/20 0.60
▸ P4HTM Q9NXG6 1/20 0.54
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ TDP1 Q9NUW8 3/20 0.49
▸ THRB P10828 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ HSP90AA1 P07900 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.44
▸ TP53 P04637 2/20 0.42

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
SCHEMBL32690204 0.77 CYP1A2 (1.00) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL9538451 0.76 MAPT (0.60) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL9541467 0.76 MAPT (0.60) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL8790381 0.76 MEN1 (1.00) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL9378633 0.75 P4HTM (0.52) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL186009 0.75 MEN1 (0.61) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL9382929 0.73 MEN1 (0.84) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL9382598 0.73 MEN1 (0.70) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL9382369 0.73 CD274 (0.77) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL9384407 0.72 KMT2A (0.64) MEN1KMT2AMAPTPOLBLMNA

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-0269030-B1 Lipid-peroxide formation inhibiting composition and novel compounds useful therefor MITSUBISHI CHEM IND (JP) 1994-05-04 — — EP disclosed
US-5089515-A Antiischemic agents; pyrazolone compounds MITSUBISHI KASEI CORPORATION (JP) 1992-02-18 — — US disclosed
US-4990619-A Cardiovascular disorders, antiischemic agents MITSUBISHI KASEI CORPORATION (JP) 1991-02-05 — — US disclosed
US-4906644-A Lipid-peroxide formation inhibiting composition and novel compounds useful therefor MITSUBISHI KASEI CORPORATION (JP) 1990-03-06 — — US disclosed
EP-0269030-A2 Lipid-peroxide formation inhibiting composition and novel compounds useful therefor MITSUBISHI KASEI CORPORATION (JP) 1988-06-01 — — EP disclosed
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