SCHEMBL20364338

SCHEMBL20364338

CC(C)(C)OC(=O)N1CCc2cc(OC=O)c(F)cc2C1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.55
▸ NR1H2 P55055 1/20 0.54
▸ MAP3K5 Q99683 3/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MAPK1 P28482 2/20 0.40
▸ HDAC1 Q13547 1/20 0.39
▸ CHRM4 P08173 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGDS O60760 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.37
▸ ABHD6 Q9BV23 1/20 0.37
▸ DDB1 Q16531 1/20 0.37
▸ CRBN Q96SW2 1/20 0.37
▸ HCRTR2 O43614 1/20 0.37

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
SCHEMBL21470911 0.85 ESR2 (0.56) ESR2NR1H2MAP3K5MEN1KMT2A
SCHEMBL30260152 0.82 ESR2 (0.64) ESR2NR1H2MAP3K5MAPK1HDAC1
SCHEMBL21470912 0.82 ESR2 (0.64) ESR2NR1H2MAP3K5MAPK1HDAC1
SCHEMBL23684302 0.82 ESR2 (0.64) ESR2NR1H2MAP3K5MAPK1HDAC1
SCHEMBL30199587 0.82 ESR2 (0.64) ESR2NR1H2MAP3K5MAPK1HDAC1
SCHEMBL20330433 0.81 ESR2 (0.60) ESR2NR1H2MAP3K5MAPK1HDAC1
SCHEMBL30935164 0.81 ESR2 (0.60) ESR2NR1H2MAP3K5MAPK1HDAC1
SCHEMBL17065001 0.81 NR1H2 (0.65) ESR2NR1H2MAP3K5MAPK1HDAC1
SCHEMBL4171400 0.81 NR1H2 (0.65) ESR2NR1H2MAP3K5MAPK1HDAC1
SCHEMBL31067606 0.81 NR1H2 (0.65) ESR2NR1H2MAP3K5MAPK1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-07-12 — — 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 (1 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-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE NR0B1, NR2E1, NR0B2 ESR2 620/4885NR1H2 313/4885MAP3K5 3026/4885

“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.

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