SCHEMBL20138309

SCHEMBL20138309

CS(=O)(=NC(=O)C(F)(F)F)c1cccc(-c2cc(F)c3c(c2)NC(=O)CO3)c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 8/20 0.42
PGR P06401 7/20 0.42
NR3C1 P04150 6/20 0.42
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
AR P10275 1/20 0.34
ADRB2 P07550 2/20 0.33
ADRB1 P08588 2/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
ACLY P53396 1/20 0.33
TRPV1 Q8NER1 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
SCHEMBL20137986 0.83 BRD4 (0.31) TRPV1
SCHEMBL4262107 0.74 NR3C2 (0.51) NR3C2PGRNR3C1PKMMAPK1
SCHEMBL4265400 0.72 NR3C2 (0.53) NR3C2PGRNR3C1ADRB2ADRB1
SCHEMBL18305164 0.71 PGR (0.47) NR3C2PGRNR3C1PKMMAPK1
SCHEMBL13343850 0.70 BRD4 (0.54) NR3C2PGRNR3C1ADRB2ADRB1
SCHEMBL18305051 0.67 CYP11B1 (0.60) NR3C2PGRNR3C1
SCHEMBL16394073 0.65 ATM (0.40) ALDH1A1
SCHEMBL16094885 0.64 F2 (0.48) ALDH1A1POLB
SCHEMBL18305166 0.64 NR3C2 (0.45) NR3C2PGRNR3C1PKMAR
SCHEMBL4272395 0.64 PGR (0.49) NR3C2PGRNR3C1ALDH1A1

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 NR3C2 2504/4885PGR 3192/4885NR3C1 1540/4885
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 NR3C2 1895/4885PGR 2723/4885NR3C1 668/4885

“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.