SCHEMBL25825789

SCHEMBL25825789

O=C(CCCO)NC1CCCCCC1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.77
HDAC3 O15379 2/20 0.65
HDAC1 Q13547 2/20 0.65
HDAC2 Q92769 2/20 0.65
HDAC10 Q969S8 2/20 0.65
HDAC11 Q96DB2 2/20 0.65
HDAC8 Q9BY41 2/20 0.65
HDAC6 Q9UBN7 2/20 0.65
NCOR2 Q9Y618 1/20 0.65
ALDH1A1 P00352 2/20 0.63
HPGD P15428 3/20 0.61
EPHX2 P34913 1/20 0.57
EPHX1 P07099 3/20 0.55
KMT2A Q03164 2/20 0.55
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.53
NPSR1 Q6W5P4 1/20 0.52
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
MEN1 O00255 1/20 0.51

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
SCHEMBL7693790 1.00 SMN1; SMN2 (0.77) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL8013586 0.94 SMN1; SMN2 (0.81) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL4404544 0.92 SMN1; SMN2 (0.78) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL28668503 0.90 SMN1; SMN2 (0.95) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL9337868 0.90 SMN1; SMN2 (0.95) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL38658755 0.88 SMN1; SMN2 (0.91) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL1698453 0.88 SMN1; SMN2 (0.69) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL6002712 0.88 SMN1; SMN2 (0.69) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL6003255 0.88 SMN1; SMN2 (0.69) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL10587847 0.85 ALDH1A1 (0.83) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10

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-4209206-A1 COSMETIC BASE INCLUDING AMIDE ALCOHOL, AND COSMETIC Kokyu Alcohol Kogyo Co., Ltd. (JP) 2023-07-12 EP disclosed