SCHEMBL6420529

SCHEMBL6420529

CN(c1ccnc(NC2CCN(C(=O)OC(C)(C)C)CC2)n1)c1nc(-c2ccccc2)cc2ncnn12

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 6/20 0.45
▸ SYK P43405 1/20 0.41
▸ GPR119 Q8TDV5 3/20 0.41
▸ MAPK14 Q16539 1/20 0.40
▸ ADORA2A P29274 1/20 0.40
▸ ABCB1 P08183 1/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ EGLN2 Q96KS0 1/20 0.39
▸ IDH1 O75874 1/20 0.39
▸ IDH2 P48735 1/20 0.39
▸ KIT P10721 1/20 0.38
▸ PRMT5 O14744 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ BRD4 O60885 1/20 0.38

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
SCHEMBL5341690 0.79 USP30 (0.48) USP30SYKGPR119MAPK14ADORA2A
SCHEMBL5914088 0.77 USP30 (0.46) USP30SYKGPR119MAPK14ADORA2A
SCHEMBL5913836 0.76 ALDH1A1 (0.48) USP30SYKGPR119MAPK14ADORA2A
SCHEMBL5263546 0.76 USP30 (0.44) USP30GPR119MAPK14ADORA2AIDH1
SCHEMBL5948116 0.75 USP30 (0.44) USP30SYKGPR119MAPK14ADORA2A
SCHEMBL5259529 0.73 ACACB (0.36) MAPK14BRD4
SCHEMBL3650816 0.72 HDAC8 (0.52) USP30SYKADORA2AIDH1IDH2
SCHEMBL3775260 0.72 USP30 (0.67) USP30GPR119ALDH1A1
SCHEMBL5913810 0.71 MAPK8 (0.48) USP30MAPK14ALDH1A1
SCHEMBL14190733 0.71 ALDH1A1 (0.55) USP30SYKGPR119ADORA2AIDH1

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-20050288502-A1 Substituted heterocyclic compounds and methods of use AMGEN, INC. 2005-12-29 — — US claimed
US-20050288502-A1 Substituted heterocyclic compounds and methods of use AMGEN, INC. 2005-12-29 — — 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-20050288502-A1 Substituted heterocyclic compounds and methods of use MYLK2, IAPP, MAPT USP30 3642/4885SYK 767/4885GPR119 154/4885

“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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