SCHEMBL20138146

SCHEMBL20138146

Cc1nn(C)c(C)c1CN1C(=O)C(C)Cc2ncc(-c3ccc4c(c3)C(=O)NCC4)cc21

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.37
MAPKAPK2 P49137 2/20 0.35
PARP10 Q53GL7 5/20 0.34
PARP1 P09874 4/20 0.34
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
GABRA5 P31644 2/20 0.32
CD274 Q9NZQ7 1/20 0.32
DRD2 P14416 5/20 0.32
PARP11 Q9NR21 1/20 0.31
F7 P08709 1/20 0.30
F3 P13726 1/20 0.30

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
SCHEMBL18305147 0.88 MAPK1 (0.39) MAPK1MAPKAPK2PARP10PARP1GABRG2
SCHEMBL20138232 0.82 MAPK1 (0.42) MAPK1MAPKAPK2PARP10PARP1CD274
SCHEMBL20138209 0.80 CYP11B2 (0.36)
SCHEMBL18304989 0.79 PIK3CA (0.35)
SCHEMBL20138151 0.78 CD274 (0.37) MAPK1MAPKAPK2PARP10PARP1GABRG2
SCHEMBL20138119 0.78 GRIN1 (0.37)
SCHEMBL20138040 0.77 SMN1; SMN2 (0.38)
SCHEMBL20138094 0.76 FYN (0.36) MAPK1
SCHEMBL18305061 0.75 FPR2 (0.33)
SCHEMBL20138147 0.75 MAPK1 (0.44) MAPK1MAPKAPK2PARP10PARP1GABRG2

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 MAPK1 1235/4885MAPKAPK2 1440/4885PARP10 1687/4885
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 MAPK1 1268/4885MAPKAPK2 1839/4885PARP10 3857/4885

“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.