SCHEMBL5267139

SCHEMBL5267139

CN(c1ccnc(NC(C)(C)CNC(=O)OC(C)(C)C)n1)c1cc(-c2ccccc2)cc(=O)n1C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 11/20 0.41
▸ ACACA Q13085 8/20 0.41
▸ CKS1B P61024 2/20 0.39
▸ SKP1 P63208 2/20 0.39
▸ SKP2 Q13309 2/20 0.39
▸ LATS1 O95835 1/20 0.38
▸ LATS2 Q9NRM7 1/20 0.38
▸ USP30 Q70CQ3 1/20 0.34
▸ PIM1 P11309 1/20 0.34
▸ PIM2 Q9P1W9 1/20 0.34
▸ PARP1 P09874 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33

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
SCHEMBL5264835 0.82 ACACB (0.44) ACACBACACACKS1BSKP1SKP2
SCHEMBL5914172 0.80 MAPK14 (0.35) CKS1BSKP1SKP2USP30
SCHEMBL5341690 0.80 USP30 (0.48) CKS1BSKP1SKP2USP30
SCHEMBL5315409 0.69 KDM4E (0.39) —
SCHEMBL5913810 0.66 MAPK8 (0.48) ACACBACACACKS1BSKP1SKP2
SCHEMBL5914098 0.63 MAPK14 (0.39) ACACBACACACKS1BSKP1SKP2
SCHEMBL5498345 0.60 LATS1 (0.44) ACACBCKS1BSKP1SKP2LATS1
SCHEMBL24742540 0.59 LTB4R (0.51) CKS1BSKP1SKP2
SCHEMBL15037007 0.59 CA12 (0.55) CKS1BSKP1SKP2
SCHEMBL13590640 0.58 ACACB (1.00) ACACBACACACKS1BSKP1SKP2

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
EP-1794135-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-06-13 — — EP claimed
WO-2006037117-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2006-04-06 — — WO claimed
US-20060069110-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2006-03-30 — — US claimed
US-20060069110-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2006-03-30 — — 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-20060069110-A1 Substituted heterocyclic compounds and methods of use MAPT, MYLK2, IAPP ACACB 2217/4885ACACA 2863/4885CKS1B 471/4885

“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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