SCHEMBL22338091

SCHEMBL22338091

COC(=O)N1CC(C)C(=O)CC1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.60
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
BRD4 O60885 2/20 0.39
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NSD2 O96028 1/20 0.31

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
SCHEMBL30900974 0.83 TSHR (0.44) TSHRLMNATP53
SCHEMBL6441114 0.83 TSHR (0.44) TSHRLMNATP53
SCHEMBL19958775 0.83 TSHR (0.44) TSHRLMNATP53
SCHEMBL6441117 0.83 TSHR (0.44) TSHRLMNATP53
SCHEMBL6441115 0.83 TSHR (0.44) TSHRLMNATP53
SCHEMBL19947075 0.79 TSHR (0.49) TSHRLMNATP53BRD4MEN1
SCHEMBL21193657 0.79 TSHR (0.49) TSHRLMNATP53BRD4MEN1
SCHEMBL16828736 0.79 TSHR (0.49) TSHRLMNATP53BRD4MEN1
SCHEMBL21192915 0.79 TSHR (0.49) TSHRLMNATP53BRD4MEN1
SCHEMBL29278492 0.79 TSHR (0.49) TSHRLMNATP53BRD4MEN1

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-2020163375-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. (US) 2020-08-13 WO disclosed