SCHEMBL11463275

SCHEMBL11463275

COC(=O)C(C)Oc1ccc(Nc2ncc(Cl)cn2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.49
▸ MAPT P10636 3/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ HDAC3 O15379 2/20 0.47
▸ HDAC1 Q13547 2/20 0.47
▸ HDAC2 Q92769 2/20 0.47
▸ HDAC6 Q9UBN7 2/20 0.47
▸ SYK P43405 1/20 0.42
▸ EPHX2 P34913 2/20 0.41
▸ LMNA P02545 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ PTK2 Q05397 1/20 0.39
▸ P2RX3 P56373 2/20 0.39

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
SCHEMBL11454422 0.87 HDAC3 (0.50) KMT2AMAPTL3MBTL1MEN1HDAC3
SCHEMBL11158124 0.83 KMT2A (0.52) KMT2AMAPTL3MBTL1MEN1EPHX2
SCHEMBL11432328 0.83 L3MBTL1 (0.48) KMT2AMAPTL3MBTL1MEN1EPHX2
SCHEMBL18331472 0.78 MEN1 (0.58) KMT2AMAPTL3MBTL1MEN1EPHX2
SCHEMBL9285601 0.78 MEN1 (0.58) KMT2AMAPTL3MBTL1MEN1EPHX2
SCHEMBL11430304 0.77 MAPT (0.58) KMT2AMAPTL3MBTL1MEN1LMNA
SCHEMBL11452294 0.77 MEN1 (0.47) KMT2AMAPTL3MBTL1MEN1HDAC3
SCHEMBL9450065 0.77 L3MBTL1 (0.71) KMT2AMAPTL3MBTL1MEN1LMNA
SCHEMBL11455680 0.77 MAPT (0.62) KMT2AMAPTL3MBTL1MEN1HDAC3
SCHEMBL8686459 0.76 MAPT (0.55) KMT2AMAPTL3MBTL1MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0013143-A2 Substituted anilinopyrimidines, compositions and use thereof as herbicides, processes for their preparation and intermediates for use therein ICI AUSTRALIA LIMITED (AU) 1980-07-09 — — EP disclosed
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