SCHEMBL20138100

SCHEMBL20138100

COc1ccc(-c2ccc3c(n2)N(Cc2c(C)nn(C)c2C)C(=O)CC3)cn1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.39
PDE2A O00408 2/20 0.37
MTOR P42345 10/20 0.36
PIK3CA P42336 11/20 0.36
PRKDC P78527 1/20 0.34
MAPT P10636 1/20 0.34
CYP11B1 P15538 1/20 0.34

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
SCHEMBL20137923 0.88 MTOR (0.37) PRMT5PDE2AMTORPIK3CAPRKDC
SCHEMBL20138177 0.82 MAPT (0.38) MAPTCYP11B1
SCHEMBL20138147 0.78 MAPK1 (0.44) MTOR
SCHEMBL20137959 0.76 RAB9A (0.37) MAPT
SCHEMBL20138283 0.76 BACE1 (0.35) PDE2AMTOR
SCHEMBL18305069 0.76 GRM2 (0.40) MTOR
SCHEMBL18304989 0.72 PIK3CA (0.35) PDE2AMTORPIK3CA
SCHEMBL20138184 0.71 MAPT (0.36) MTORMAPT
SCHEMBL20138155 0.70 CYP11B1 (0.34) MTORCYP11B1
SCHEMBL20138135 0.69 GRM2 (0.40)

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 PRMT5 4853/4885PDE2A 766/4885MTOR 3479/4885
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 PRMT5 4798/4885PDE2A 571/4885MTOR 3921/4885

“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.