SCHEMBL6607624

SCHEMBL6607624

CN(C)c1ccc(-c2nc(-c3ccccc3/C=C/c3nc4ccccc4s3)[nH]c2-c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.55
▸ KMT2A Q03164 6/20 0.55
▸ MAPT P10636 5/20 0.55
▸ APP P05067 4/20 0.55
▸ RAB9A P51151 4/20 0.55
▸ INSR P06213 3/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ NCOA1 Q15788 1/20 0.55
▸ NOX1 Q9Y5S8 1/20 0.51
▸ NPC1 O15118 3/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ALOX5 P09917 1/20 0.41
▸ SNCA P37840 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MGAM O43451 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
SCHEMBL3826536 0.94 MEN1 (0.48) MEN1KMT2AMAPTAPPRAB9A
SCHEMBL6609826 0.78 NOX1 (0.51) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL3824183 0.73 NOX1 (0.45) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL476579 0.72 MEN1 (1.00) MEN1KMT2AMAPTAPPRAB9A
SCHEMBL29413750 0.72 MEN1 (1.00) MEN1KMT2AMAPTAPPRAB9A
SCHEMBL29433017 0.72 MEN1 (1.00) MEN1KMT2AMAPTAPPRAB9A
SCHEMBL476578 0.72 MEN1 (1.00) MEN1KMT2AMAPTAPPRAB9A
SCHEMBL15949927 0.72 MEN1 (0.62) MEN1KMT2AMAPTAPPRAB9A
SCHEMBL11310551 0.72 MEN1 (0.62) MEN1KMT2AMAPTAPPRAB9A
Bromide SCHEMBL8389953 0.71 MEN1 (0.97) MEN1KMT2AMAPTAPPRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0999835-A4 IMIDAZOLE DERIVATIVES AS MDR MODULATORS ONTOGEN CORP (US) 2004-08-25 — — EP disclosed
EP-0999835-A1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS Ontogen Corporation (US) 2000-05-17 — — EP disclosed
WO-1999002155-A1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS ONTOGEN CORPORATION (US) 1999-01-21 — — WO disclosed
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