SCHEMBL23735304

SCHEMBL23735304

CC1COc2cccc(O)c2CN1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.39
UCHL1 P09936 2/20 0.35
MAOA P21397 3/20 0.35
GRM5 P41594 1/20 0.34
MAOB P27338 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMARCA2 P51531 1/20 0.34
SMARCA4 P51532 1/20 0.34
PBRM1 Q86U86 1/20 0.34

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
SCHEMBL19667578 1.00 HSD11B1 (0.39) HSD11B1UCHL1MAOAGRM5MAOB
SCHEMBL19679354 1.00 HSD11B1 (0.39) HSD11B1UCHL1MAOAGRM5MAOB
SCHEMBL20873514 0.82 SMN1; SMN2 (0.37) MAOAMAOBMEN1KMT2A
SCHEMBL23716523 0.82 SMN1; SMN2 (0.37) MAOAMAOBMEN1KMT2A
SCHEMBL20873513 0.82 SMN1; SMN2 (0.37) MAOAMAOBMEN1KMT2A
SCHEMBL19684900 0.81 KCNH2 (0.40)
SCHEMBL19667491 0.80 HSD11B1 (0.41) HSD11B1UCHL1MEN1KMT2A
SCHEMBL30207832 0.80 HSD11B1 (0.41) HSD11B1UCHL1MEN1KMT2A
SCHEMBL19667670 0.80 KLK7 (0.42)
SCHEMBL22366355 0.78 UCHL1 (0.42) HSD11B1UCHL1MEN1KMT2A

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-3464249-B1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER (US) 2021-08-11 EP disclosed