SCHEMBL13683529

SCHEMBL13683529

COC1=NN(C)C(=O)/C1=C/C=C1/Oc2ccccc2N1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.36
▸ KMT2A Q03164 7/20 0.36
▸ MAPK1 P28482 4/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ TNNI3 P19429 1/20 0.36
▸ TNNT2 P45379 1/20 0.36
▸ TNNC1 P63316 1/20 0.36
▸ ALDH1A1 P00352 5/20 0.35
▸ MAPT P10636 5/20 0.35
▸ HTT P42858 4/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ P2RX4 Q99571 1/20 0.33
▸ KDM4E B2RXH2 4/20 0.32
▸ GAA P10253 4/20 0.32
▸ LMNA P02545 3/20 0.31
▸ IDH1 O75874 1/20 0.31

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
SCHEMBL13805787 0.86 ALDH1A1 (0.34) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL14016488 0.83 MEN1 (0.36) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL13683533 0.82 ALDH1A1 (0.36) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL13683528 0.82 MEN1 (0.36) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL13683512 0.81 MEN1 (0.35) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL13683513 0.81 MEN1 (0.36) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL13805791 0.81 MAPT (0.37) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL13683511 0.81 ALDH1A1 (0.39) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL13683527 0.80 ALDH1A1 (0.34) MEN1KMT2AMAPK1TDP1TNNI3
SCHEMBL13683534 0.80 P2RX4 (0.38) MEN1KMT2AMAPK1TDP1TNNI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595139-B2 Metal complex dye, color toner and color filter KONICA MINOLTA HOLDINGS, INC. (JP) 2009-09-29 — — US disclosed
US-7595139-B2 Metal complex dye, color toner and color filter KONICA MINOLTA HOLDINGS, INC. (JP) 2009-09-29 — — US disclosed
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