SCHEMBL4874927

SCHEMBL4874927

CC(C)(C)OC(=O)N1CCC(c2ccoc2)C(OCc2ccc(-c3ccccc3)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 7/20 0.46
BACE1 P56817 1/20 0.46
BACE2 Q9Y5Z0 1/20 0.46
GPR119 Q8TDV5 3/20 0.44
PRMT5 O14744 3/20 0.42
TACR1 P25103 1/20 0.42
YAP1 P46937 2/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
KLK7 P49862 1/20 0.41

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
SCHEMBL4874370 0.94 JAK2 (0.46) USP30BACE1BACE2GPR119PRMT5
SCHEMBL4862367 0.91 YAP1 (0.42) USP30BACE1BACE2GPR119PRMT5
SCHEMBL4865775 0.89 GPR119 (0.40) BACE1GPR119TACR1YAP1JAK2
SCHEMBL4872229 0.88 REN (0.41) BACE1BACE2GPR119PRMT5TACR1
SCHEMBL4871295 0.82 ACHE (0.42) USP30GPR119TACR1JAK2JAK1
SCHEMBL4865612 0.82 CTSV (0.41) KLK7
SCHEMBL6621977 0.80 GPR119 (0.41) GPR119PRMT5TACR1JAK2JAK1
SCHEMBL14265640 0.80 GPR119 (0.45) USP30GPR119TACR1JAK2JAK1
SCHEMBL2807737 0.79 BACE1 (0.45) USP30BACE1BACE2PRMT5TACR1
SCHEMBL2807739 0.79 BACE1 (0.45) USP30BACE1BACE2PRMT5TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7338965-B2 3,4-disubstituted, 3,5-disubstituted and 3,4,5-substituted piperidines PHARMACIA & UPJOHN COMPANY (US) 2008-03-04 US disclosed
US-20040034031-A1 3,4-Disubstituted, 3,5-disubstituted and 3,4,5-substituted piperidines ELAN PHARMACEUTICALS, INC. 2004-02-19 US 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 (1 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-20040034031-A1 3,4-Disubstituted, 3,5-disubstituted and 3,4,5-substituted piperidines BACE1, APP, BACE2 USP30 1035/4885BACE1 1/4885BACE2 3/4885

“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.