SCHEMBL17305465

SCHEMBL17305465

CC(C)(C)OC(=O)C1CCN(c2cc(Cl)ccc2/C=C/[N+](=O)[O-])CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ FBP1 P09467 3/20 0.42
▸ LMNA P02545 3/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ NOTUM Q6P988 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ STS P08842 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ PSMD14 O00487 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ POLB P06746 1/20 0.36
▸ MITF O75030 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NTSR1 P30989 1/20 0.36

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
SCHEMBL19078469 0.86 MAPT (0.48) MAPTL3MBTL1FBP1NOTUMALDH1A1
SCHEMBL19087943 0.84 MAPT (0.44) MAPTL3MBTL1LMNAMAPK1NOTUM
SCHEMBL19078428 0.76 HTR3E (0.53) MAPTL3MBTL1LMNANOTUMALDH1A1
SCHEMBL19078440 0.73 MAPT (0.42) MAPTL3MBTL1LMNAMAPK1NOTUM
SCHEMBL19078423 0.72 MAPT (0.43) MAPTL3MBTL1NOTUMALDH1A1STS
SCHEMBL19078390 0.72 MAPT (0.42) MAPTL3MBTL1NOTUMALDH1A1STS
SCHEMBL22839753 0.71 MAPT (0.43) MAPTL3MBTL1LMNANOTUMALDH1A1
SCHEMBL19087942 0.71 MAPT (0.42) MAPTL3MBTL1MAPK1ALDH1A1TP53
SCHEMBL17305384 0.71 MAPT (0.39) MAPTL3MBTL1LMNANOTUMALDH1A1
SCHEMBL8312209 0.70 MAPT (0.72) MAPTL3MBTL1LMNAMAPK1NOTUM

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
US-9981960-B2 Pyrrolidine compound and application as melanocortin receptor agonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2018-05-29 — — US disclosed
US-20170190697-A1 NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-07-06 — — US disclosed
US-20170190697-A1 NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-07-06 — — US disclosed
WO-2015182723-A1 NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST 田辺三菱製薬株式会社 2015-12-03 — — WO 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-20170190697-A1 NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST MC1R, MC5R, MC3R MAPT 3317/4885L3MBTL1 3781/4885FBP1 4842/4885

“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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