SCHEMBL20138086

SCHEMBL20138086

COCCOCc1c(CN2C(=O)[C@@H](C)Oc3c(F)cc(-c4cccc(S(C)(=O)=O)c4)cc32)c(C)nn1C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.32

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
SCHEMBL18305093 0.87 NR1H2 (0.31) NR1H2
SCHEMBL20137953 0.86 SMN1; SMN2 (0.37) NR1H2
SCHEMBL20138182 0.85 NR1H2 (0.34) NR1H2
SCHEMBL20138176 0.85 REN (0.31) NR1H2
SCHEMBL20138186 0.83 RAF1 (0.35) NR1H2
SCHEMBL20138164 0.82 TSHR (0.30)
SCHEMBL20137998 0.82 KCNH2 (0.33) NR1H2
SCHEMBL20138116 0.82 SMN1; SMN2 (0.36)
SCHEMBL20138288 0.81 MEN1 (0.34) NR1H2
SCHEMBL20138055 0.81 CHRM1 (0.33) NR1H2

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 NR1H2 592/4885
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 NR1H2 1167/4885

“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.