SCHEMBL20138045

SCHEMBL20138045

COCCOCc1cc(C)nn1C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.36
KCNH2 Q12809 11/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GRIN2B Q13224 1/20 0.34
DAO P14920 1/20 0.33
RIPK1 Q13546 1/20 0.32
MPO P05164 1/20 0.32
F2RL3 Q96RI0 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
SCHEMBL8270922 0.83 FFAR1 (0.40) FFAR1KCNH2GRIN2BDAORIPK1
SCHEMBL12126170 0.80 FFAR1 (0.44) FFAR1KCNH2GRIN2BDAOMPO
SCHEMBL12126268 0.77 FFAR1 (0.42) FFAR1KCNH2GRIN2BDAOMPO
SCHEMBL2608838 0.76 FFAR1 (0.39) FFAR1KCNH2GRIN2BDAOMPO
SCHEMBL13402954 0.75 MAPK1 (0.46) MEN1KMT2A
SCHEMBL25038987 0.71 FFAR1 (0.38) FFAR1KCNH2GRIN2BDAOMPO
SCHEMBL324196 0.70 FFAR1 (0.40) FFAR1KCNH2GRIN2BDAOMPO
SCHEMBL12126344 0.69 FFAR1 (0.44) FFAR1KCNH2MEN1KMT2ADAO
SCHEMBL28311316 0.69 GLS (0.53) MEN1KMT2A
SCHEMBL24933018 0.69 FFAR1 (0.53) FFAR1KCNH2MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107873031-B Benzoxazinone derivatives and analogs thereof as modulators of TNF activity UCB生物制药私人有限公司 2021-03-12 CN disclosed
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 FFAR1 1580/4885KCNH2 2028/4885MEN1 4094/4885
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 FFAR1 501/4885KCNH2 2809/4885MEN1 4202/4885

“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.