SCHEMBL20138263

SCHEMBL20138263

Cc1nc2cnccn2c1CN1C(=O)[C@@H](C)Oc2c(F)cc(Br)cc21

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL20137958 0.86 TSHR (0.39) TSHRMEN1KMT2A
SCHEMBL18128119 0.83 TSHR (0.33) TSHRMEN1KMT2A
SCHEMBL20138212 0.79 PRNP (0.33) TSHRMEN1KMT2A
SCHEMBL20138239 0.79 SLC2A1 (0.35)
SCHEMBL18128277 0.79 MEN1 (0.35) TSHRMEN1KMT2A
SCHEMBL18128076 0.79 MEN1 (0.35) TSHRMEN1KMT2A
SCHEMBL20138161 0.78 CDK4 (0.37)
SCHEMBL18128105 0.78
SCHEMBL18128264 0.77 MEN1 (0.34) TSHRMEN1KMT2A
SCHEMBL18128217 0.77 MEN1 (0.34) TSHRMEN1KMT2A

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 TSHR 2169/4885MEN1 4094/4885KMT2A 3814/4885
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 TSHR 940/4885MEN1 4202/4885KMT2A 3061/4885

“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.