SCHEMBL24696247

SCHEMBL24696247

CCOC(=O)CC(=O)CC1CCC(F)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.45
MGAM O43451 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
ALDH1A1 P00352 4/20 0.34
TRPA1 O75762 1/20 0.34
SMYD3 Q9H7B4 1/20 0.33
MAPT P10636 4/20 0.33
KDM4E B2RXH2 4/20 0.33
ALOX15 P16050 2/20 0.33
HSD17B10 Q99714 2/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
EPHX2 P34913 1/20 0.33
LMNA P02545 2/20 0.32
TRPM8 Q7Z2W7 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
SCHEMBL1015154 0.91 GAA (0.54) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL24696141 0.86 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL24696377 0.85 GAA (0.47) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL2555598 0.84 MGAM (0.50) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL3109485 0.84 GAA (0.50) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL2408506 0.83 MGAM (0.45) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL6160915 0.83 MGAM (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL3106991 0.83 MGAM (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL24695618 0.83 GAA (0.41) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL1021852 0.82 MEN1 (0.49) GAAMGAMSIMGAM2ALDH1A1

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-2022255408-A1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUND FOR THE TREATMENT OF DERMAL DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2022-12-08 WO disclosed