SCHEMBL20138228

SCHEMBL20138228

Cc1ccnc(C)c1CN1C(=O)COc2ccc(B3OC(C)(C)C(C)(C)O3)nc21

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.31
APOBEC3A P31941 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30

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
SCHEMBL20138128 0.83 SHMT2 (0.34)
SCHEMBL20137924 0.81 BRD4 (0.35) BRD4APOBEC3AAPOBEC3G
SCHEMBL20138207 0.76 SSTR5 (0.36)
SCHEMBL20138019 0.70 MTOR (0.40) BRD4
SCHEMBL20138109 0.70 MAPK1 (0.43) BRD4
SCHEMBL20138275 0.69 BRD4 (0.34) BRD4
SCHEMBL20138042 0.68 CDC7 (0.35)
SCHEMBL20138284 0.65 TSHR (0.39) BRD4APOBEC3AAPOBEC3G
SCHEMBL20138056 0.65 TSHR (0.32)
SCHEMBL20138099 0.65 TSHR (0.32)

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-10287299-B2 Substituted benzo[b][1,4]oxazines and pyrido[3,2-b][1,4]oxazines as modulators of tumor necrosis factor activity UCB BIOPHARMA SPRL (BE) 2019-05-14 US disclosed
US-20180134728-A1 Benzoxazinone Derivatives and Analogues Thereof as Modulators of TNF Activity UCB S.A. (BE) 2018-05-17 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 (2 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-20180134728-A1 Benzoxazinone Derivatives and Analogues Thereof as Modulators of TNF Activity TNF, NFKBIA, TNFRSF1A BRD4 1801/4885APOBEC3A 4450/4885APOBEC3G 4366/4885
US-10287299-B2 Substituted benzo[b][1,4]oxazines and pyrido[3,2-b][1,4]oxazines as modulators of tumor necrosis factor activity TNF, TNFRSF1A, NFKBIA BRD4 2210/4885APOBEC3A 3851/4885APOBEC3G 4292/4885

“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.