SCHEMBL17605153

SCHEMBL17605153

CC(C)(C)OC(=O)N1CCCC(NCc2ccc(F)cc2)C1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 2/20 0.50
▸ DNMT3A Q9Y6K1 1/20 0.47
▸ HDAC4 P56524 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.46
▸ TRPV3 Q8NET8 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ TP53 P04637 1/20 0.44
▸ GPR119 Q8TDV5 1/20 0.44
▸ BCHE P06276 1/20 0.44
▸ ACHE P22303 1/20 0.44
▸ BACE1 P56817 1/20 0.44
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43
▸ GFER P55789 1/20 0.43
▸ BRD3 Q15059 1/20 0.43
▸ BRD4 O60885 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL17605512 1.00 USP30 (0.50) USP30DNMT3AHDAC4HDAC6TRPV3
SCHEMBL17605154 1.00 USP30 (0.50) USP30DNMT3AHDAC4HDAC6TRPV3
SCHEMBL17605157 0.93 DNMT3A (0.52) USP30DNMT3AALDH1A1TP53GPR119
SCHEMBL17605155 0.93 DNMT3A (0.52) USP30DNMT3AALDH1A1TP53GPR119
SCHEMBL14747175 0.89 HTT (0.51) USP30HDAC4HDAC6ALDH1A1SMN1; SMN2
SCHEMBL13434283 0.89 HTT (0.51) USP30HDAC4HDAC6ALDH1A1SMN1; SMN2
SCHEMBL22222650 0.89 USP30 (0.62) USP30GPR119BCHEACHE
SCHEMBL28779687 0.89 USP30 (0.62) USP30GPR119BCHEACHE
SCHEMBL20794647 0.86 DNMT3A (0.45) DNMT3ASMN1; SMN2TP53GPR119HDAC1
SCHEMBL4139902 0.86 DNMT3A (0.56) DNMT3AALDH1A1TP53GPR119BCHE

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180193315-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC (US) 2018-07-12 — — US disclosed
US-20180071262-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2018-03-15 — — US disclosed
US-20160235716-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2016-08-18 — — US disclosed
WO-2016044770-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2016-03-24 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160235716-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, HDAC9 USP30 2861/4885DNMT3A 1706/4885HDAC4 21/4885
US-20180193315-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, KAT2A USP30 2917/4885DNMT3A 1575/4885HDAC4 20/4885
US-20180071262-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, HDAC9 USP30 2861/4885DNMT3A 1706/4885HDAC4 21/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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