SCHEMBL16456393

SCHEMBL16456393

C[C@H]1CC[C@H](N2Cc3cc(C#N)ccc3NC2=O)CC1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 4/20 0.61
▸ BRD4 O60885 2/20 0.42
▸ MAPK1 P28482 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HTR2A P28223 3/20 0.39
▸ HTR2C P28335 3/20 0.39
▸ HTR2B P41595 2/20 0.39
▸ CYP11B2 P19099 1/20 0.38
▸ CALCRL Q16602 1/20 0.37
▸ KDR P35968 1/20 0.36
▸ ALK Q9UM73 1/20 0.36
▸ PKM P14618 1/20 0.35
▸ LRRK2 Q5S007 1/20 0.34
▸ MAPKAPK2 P49137 1/20 0.34
▸ PDE4A P27815 1/20 0.34

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
SCHEMBL3601664 0.87 TNKS (0.58) TNKSBRD4MAPK1KDM4EALDH1A1
SCHEMBL16456384 0.87 TNKS (0.58) TNKSBRD4MAPK1KDM4EALDH1A1
SCHEMBL16456006 0.82 PKM (0.46) TNKSBRD4MAPK1CALCRLPKM
SCHEMBL3599617 0.81 TNKS (0.55) TNKSKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL16444848 0.77 TNKS (1.00) TNKS
SCHEMBL15289104 0.77 TNKS (1.00) TNKS
SCHEMBL16444847 0.77 TNKS (1.00) TNKS
SCHEMBL13884718 0.75 TNKS (0.46) TNKSMAPK1KDM4EALDH1A1MAPT
SCHEMBL2872824 0.69 BRD4 (0.56) BRD4CALCRL
SCHEMBL3603875 0.69 BRD4 (0.55) TNKSBRD4MAPK1CALCRLPKM

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-9340549-B2 Oxazolidinone compounds and derivatives thereof AMGEN INC. (US) 2016-05-17 — — US disclosed
US-20150045368-A1 OXAZOLIDINONE COMPOUNDS AND DERIVATIVES THEREOF AMGEN INC. 2015-02-12 — — 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-20150045368-A1 OXAZOLIDINONE COMPOUNDS AND DERIVATIVES THEREOF TNKS1BP1, TNKS, TBKBP1 TNKS 2/4885BRD4 1444/4885MAPK1 1337/4885

“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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