SCHEMBL5083436

SCHEMBL5083436

CC(C)(C)OC(=O)N1CCC(NCc2ccc(-c3cccc(C(N)=O)c3)nc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.45
HPGDS O60760 1/20 0.45
GPR119 Q8TDV5 6/20 0.44
PARP14 Q460N5 1/20 0.44
SCN9A Q15858 1/20 0.44
CHEK2 O96017 2/20 0.43
CCNT1 O60563 1/20 0.42
PARP1 P09874 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
HDAC1 Q13547 1/20 0.42
KDM1A O60341 1/20 0.42

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
SCHEMBL5086233 0.90 GPR119 (0.52) USP30GPR119SCN9ACHEK2HDAC1
SCHEMBL3983980 0.88 USP30 (0.46) USP30HPGDSGPR119KDM4EPKM
SCHEMBL3984528 0.86 GPR119 (0.49) USP30HPGDSGPR119CCNT1HDAC1
SCHEMBL3984556 0.86 KDM1A (0.47) HPGDSKDM1A
SCHEMBL1347367 0.83 KDM1A (0.47) HPGDSKDM1A
SCHEMBL1346051 0.83 KDM1A (0.47) HPGDSKDM1A
SCHEMBL1346050 0.83 KDM1A (0.47) HPGDSKDM1A
SCHEMBL1348274 0.81 KDM1A (0.49) HPGDSKDM1A
SCHEMBL4097506 0.81 GPR119 (0.57) USP30GPR119HDAC1
SCHEMBL3987089 0.80 GPR119 (0.59) GPR119

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
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 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-20080103123-A1 New compounds GPR119, GPR139, GPR180 USP30 3721/4885HPGDS 2571/4885GPR119 1/4885

“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.