SCHEMBL13683534

SCHEMBL13683534

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 5/20 0.38
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ TNNI3 P19429 1/20 0.36
▸ TNNT2 P45379 1/20 0.36
▸ TNNC1 P63316 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ GAA P10253 2/20 0.34
▸ ABL1 P00519 3/20 0.34
▸ MAPT P10636 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 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
SCHEMBL13683533 0.88 ALDH1A1 (0.36) P2RX4MEN1KMT2AMAPK1TNNI3
SCHEMBL13805789 0.82 KMT2A (0.39) P2RX4MEN1KMT2AMAPK1TNNI3
SCHEMBL13805791 0.82 MAPT (0.37) P2RX4MEN1KMT2AMAPK1TNNI3
SCHEMBL13683511 0.80 ALDH1A1 (0.39) P2RX4MEN1KMT2AMAPK1TNNI3
SCHEMBL13683529 0.80 MEN1 (0.36) P2RX4MEN1KMT2AMAPK1TNNI3
SCHEMBL14016488 0.79 MEN1 (0.36) MEN1KMT2AMAPK1TNNI3TNNT2
SCHEMBL13683528 0.78 MEN1 (0.36) P2RX4MEN1KMT2AMAPK1TNNI3
SCHEMBL13805787 0.78 ALDH1A1 (0.34) P2RX4MEN1KMT2AMAPK1TNNI3
SCHEMBL13683539 0.78 KDM4E (0.36) P2RX4MEN1KMT2AMAPK1TNNI3
SCHEMBL13683512 0.77 MEN1 (0.35) MEN1KMT2AMAPK1TNNI3TNNT2

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
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
US-7553797-B2 Thermal transfer recording material and thermal transfer recording method KONICA MINOLTA PHOTO IMAGING, INC. (JP) 2009-06-30 — — US disclosed
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