SCHEMBL9379697

SCHEMBL9379697

O=C1CC(Cc2ncc[nH]2)=NN1c1ccc(O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SHMT2 P34897 1/20 0.42
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ TAAR1 Q96RJ0 5/20 0.37
▸ MAPT P10636 3/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ ALOX15 P16050 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ TBXAS1 P24557 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ APP P05067 2/20 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
SCHEMBL9378209 0.88 SHMT2 (0.46) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9379481 0.88 SHMT2 (0.56) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9379889 0.87 KMT2A (0.49) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9378235 0.87 SHMT2 (0.42) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9377633 0.86 POLB (0.45) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9379615 0.85 SHMT2 (0.49) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9379666 0.84 GAA (0.43) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9378519 0.84 GAA (0.57) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9385358 0.83 GAA (0.45) SHMT2MEN1KMT2AGAAALDH1A1
SCHEMBL9379259 0.81 TAAR1 (0.41) SHMT2MEN1KMT2AGAAALDH1A1

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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