SCHEMBL19833934

SCHEMBL19833934

CC(Oc1ccc(F)c(F)c1F)C1CN(C(=O)c2cc3c(cc2F)OCC(=O)N3)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NR3C2 P08235 6/20 0.42
▸ NR3C1 P04150 4/20 0.42
▸ MAP3K5 Q99683 1/20 0.39
▸ MGLL Q99685 3/20 0.38
▸ PGR P06401 1/20 0.37
▸ DHODH Q02127 1/20 0.36
▸ TRPV1 Q8NER1 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ ENPP2 Q13822 1/20 0.35

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
SCHEMBL19833759 0.92 MAP3K5 (0.42) NR3C2NR3C1MAP3K5MGLLPGR
SCHEMBL19847887 0.90 NR3C2 (0.40) NR3C2NR3C1MAP3K5MGLLPGR
SCHEMBL19833864 0.90 NR3C2 (0.45) NR3C2NR3C1MAP3K5MGLLPGR
SCHEMBL19834105 0.90 MGLL (0.43) NR3C2NR3C1MAP3K5MGLLPGR
SCHEMBL19833835 0.88 CPS1 (0.41) NR3C2NR3C1MAP3K5PGRDHODH
SCHEMBL19833872 0.87 MGLL (0.51) NR3C2NR3C1MAP3K5MGLLPGR
SCHEMBL19833873 0.86 MAP3K5 (0.43) NR3C2NR3C1MAP3K5PGRTRPV1
SCHEMBL19833912 0.85 NR3C2 (0.39) NR3C2NR3C1MAP3K5MGLLPGR
SCHEMBL19834174 0.82 MGLL (0.49) NR3C2NR3C1MAP3K5MGLLPGR
SCHEMBL19833904 0.80 MGLL (0.57) NR3C2NR3C1MGLLPGRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3279191-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2020-09-02 — — EP disclosed
US-10106556-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-10-23 — — US disclosed
US-20180079756-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-22 — — US disclosed
EP-3279191-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2018-02-07 — — EP 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-20180079756-A1 HETEROCYCLIC COMPOUND MAG, ACHE, HTT NR3C2 2434/4885NR3C1 1340/4885MAP3K5 1965/4885
US-10106556-B2 Heterocyclic compound MAG, ACHE, HTT NR3C2 2434/4885NR3C1 1340/4885MAP3K5 1965/4885

“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.

Send feedback