SCHEMBL13683616

SCHEMBL13683616

CC(C)N1N=C(C#N)/C(=C\C=C2\CCCN2C)C1=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.40
▸ MAPT P10636 4/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ GAA P10253 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ PSMD14 O00487 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ IDE P14735 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ USP2 O75604 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ BRD4 O60885 1/20 0.32
▸ BRD2 P25440 1/20 0.32

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
SCHEMBL13683607 0.85 MEN1 (0.44) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL13683610 0.78 MEN1 (0.30) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL13683622 0.73 MEN1 (0.36) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL13683633 0.71 EPHX2 (0.31) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL14269386 0.67 KMT2A (0.56) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL2058995 0.67 KMT2A (0.56) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL2058993 0.67 KMT2A (0.56) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL25477347 0.65 MEN1 (0.46) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL19240021 0.65 MAPT (0.47) MEN1MAPTKMT2AGAAALDH1A1
SCHEMBL13683587 0.64 MEN1 (0.44) MEN1MAPTKMT2AGAAALDH1A1

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
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
US-7553797-B2 Thermal transfer recording material and thermal transfer recording method KONICA MINOLTA PHOTO IMAGING, INC. (JP) 2009-06-30 — — US disclosed
EP-1619040-B1 Thermal transfer recording material and thermal transfer recording method DAINIPPON PRINTING CO LTD (JP) 2008-11-19 — — EP disclosed
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