SCHEMBL20138304

SCHEMBL20138304

Cc1cnnc(C)c1CN1C(=O)COc2c(C)cc(Br)nc21

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 5/20 0.33
SLC5A1 P13866 2/20 0.33
TERT O14746 1/20 0.31

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
SCHEMBL20138198 0.76 SLC5A2 (0.35) SLC5A2SLC5A1TERT
SCHEMBL20138262 0.76 MAPK1 (0.37) SLC5A2SLC5A1
SCHEMBL20138003 0.68 SLC5A2 (0.33) SLC5A2SLC5A1
SCHEMBL20137997 0.67 TSHR (0.37)
SCHEMBL20137924 0.65 BRD4 (0.35)
SCHEMBL20138084 0.62 TSHR (0.35)
SCHEMBL20137985 0.61 ALDH1A1 (0.32)
SCHEMBL20137971 0.61 SMN1; SMN2 (0.36) SLC5A2SLC5A1TERT
SCHEMBL9838053 0.58 HTR6 (0.49)
SCHEMBL1334990 0.58 PDE3B (0.39)

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 SLC5A2 2150/4885SLC5A1 1345/4885TERT 4230/4885
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 SLC5A2 3396/4885SLC5A1 2429/4885TERT 4468/4885

“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.