SCHEMBL23747726

SCHEMBL23747726

CCOC1CC1NCC(C=O)c1ccc(NC(=O)NCc2ccc(OC)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.48
▸ NPC1 O15118 4/20 0.47
▸ RAB9A P51151 4/20 0.47
▸ ROCK2 O75116 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ EPHX2 P34913 2/20 0.42
▸ NAMPT P43490 5/20 0.42
▸ MAPT P10636 2/20 0.41

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
SCHEMBL23747784 0.80 SMN1; SMN2 (0.58) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
SCHEMBL17916794 0.72 SMN1; SMN2 (0.88) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
SCHEMBL23747428 0.71 SMN1; SMN2 (0.75) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
SCHEMBL23747385 0.70 SMN1; SMN2 (0.70) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
SCHEMBL23728131 0.70 SMN1; SMN2 (0.73) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
Hydrochloric Acid SCHEMBL26100519 0.69 SMN1; SMN2 (0.68) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
Hydrochloric Acid SCHEMBL23728254 0.69 SMN1; SMN2 (0.68) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
SCHEMBL23747822 0.68 SMN1; SMN2 (0.75) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
SCHEMBL23727608 0.68 MEN1 (0.81) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1
SCHEMBL23747521 0.68 SMN1; SMN2 (0.67) MEN1KMT2AL3MBTL1SMN1; SMN2HDAC1

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
WO-2021159015-A1 NAMPT MODULATORS CYTOKINETICS, INC. (US) 2021-08-12 — — WO disclosed
Send feedback