SCHEMBL9382490

SCHEMBL9382490

Cc1cccc(N2N=C(Cc3ncc[nH]3)CC2=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SHMT2 P34897 1/20 0.43
▸ TAAR1 Q96RJ0 5/20 0.42
▸ MAPT P10636 4/20 0.41
▸ GAA P10253 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ HTR1A P08908 1/20 0.40
▸ APP P05067 2/20 0.39
▸ L3MBTL1 Q9Y468 4/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CHRM2 P08172 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CHRM1 P11229 1/20 0.37

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) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9378229 0.87 GAA (0.45) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9379259 0.86 TAAR1 (0.41) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9379481 0.86 SHMT2 (0.56) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9378321 0.81 TAAR1 (0.41) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9379615 0.80 SHMT2 (0.49) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9379697 0.80 SHMT2 (0.42) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9379889 0.80 KMT2A (0.49) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9378235 0.80 SHMT2 (0.42) SHMT2TAAR1MAPTGAAKMT2A
SCHEMBL9378519 0.79 GAA (0.57) SHMT2TAAR1MAPTGAAKMT2A

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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