SCHEMBL10674909

SCHEMBL10674909

CN(C(=O)c1c(O)c2ccc(Cl)cc2n(C)c1=O)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.74
▸ KMT2A Q03164 3/20 0.74
▸ PGR P06401 1/20 0.74
▸ CYP2C19 P33261 1/20 0.52
▸ SRC P12931 1/20 0.49
▸ HIF1A Q16665 9/20 0.48
▸ GSK3B P49841 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.46
▸ TSPO P30536 1/20 0.45

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
SCHEMBL10674315 0.91 MEN1 (0.74) MEN1KMT2APGRCYP2C19SRC
SCHEMBL9279359 0.87 MEN1 (0.56) MEN1KMT2APGRCYP2C19HIF1A
SCHEMBL10671529 0.86 MEN1 (0.81) MEN1KMT2APGRSRCALDH1A1
SCHEMBL10671773 0.85 MEN1 (0.54) MEN1KMT2APGRCYP2C19SRC
Roquinimex SCHEMBL42132 0.85 KMT2A (1.00) MEN1KMT2APGRSRCALDH1A1
Roquinimex SCHEMBL8169579 0.85 KMT2A (1.00) MEN1KMT2APGRSRCALDH1A1
Roquinimex SCHEMBL29359144 0.85 KMT2A (1.00) MEN1KMT2APGRSRCALDH1A1
SCHEMBL24172646 0.84 MEN1 (0.71) MEN1KMT2APGRSRCHIF1A
SCHEMBL10675968 0.81 MEN1 (0.77) MEN1KMT2APGRSRCHIF1A
SCHEMBL10671888 0.80 MEN1 (0.76) MEN1KMT2APGRSRCHIF1A

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
US-4738971-A ENHANCED CELL-MEDIATED IMMUNITY; ANTIARTHRITIC AGENTS; NONTOXIC AKTIEBOLASET LEO (SE) 1988-04-19 — — US disclosed
US-4547511-A FOR ENHANCIN CELL-MEDIATED IMMUNITY AKTIEBOLAGET LEO (SE) 1985-10-15 — — US disclosed
EP-0059698-B1 HETEROCYCLIC CARBOXAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND METHODS OF TREATMENT THEREWITH AB LEO (SE) 1985-09-25 — — EP disclosed
EP-0059698-A1 Heterocyclic carboxamides, compositions containing such compounds, processes for their preparation and methods of treatment therewith AB LEO (SE) 1982-09-08 — — EP disclosed
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