SCHEMBL8778459

SCHEMBL8778459

O=C1NCCCCC1(Cl)Cl

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FKBP5 Q13451 1/20 0.37
CRBN Q96SW2 1/20 0.37
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33
OR51E2 Q9H255 1/20 0.33
CCR2 P41597 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
SCHEMBL1688444 0.98 FKBP5 (0.36) FKBP5CRBNGRIN1GRIN2AOR51E2
SCHEMBL1997375 0.93
SCHEMBL9320311 0.76 FKBP5 (0.37) FKBP5CRBNGRIN1GRIN2AOR51E2
SCHEMBL9129408 0.75 CRBN (0.40) FKBP5CRBNGRIN1GRIN2AOR51E2
SCHEMBL6673999 0.73 FKBP5 (0.39) FKBP5CRBNGRIN1GRIN2AOR51E2
SCHEMBL11316947 0.73 FKBP5 (0.39) FKBP5CRBNGRIN1GRIN2AOR51E2
SCHEMBL23009712 0.71 FKBP5 (0.37) FKBP5CRBNGRIN1GRIN2AOR51E2
SCHEMBL11723152 0.71 FKBP5 (0.37) FKBP5CRBNGRIN1GRIN2AOR51E2
SCHEMBL466252 0.71 FKBP5 (0.37) FKBP5CRBNGRIN1GRIN2AOR51E2
SCHEMBL6118648 0.71 FKBP5 (0.37) FKBP5CRBNGRIN1GRIN2AOR51E2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804530-A1 BLEACHING COMPOSITIONS AND ADDITIVES COMPRISING BLEACH ACTIVATORS HAVING ALPHA-MODIFIED LACTAM LEAVING-GROUPS THE PROCTER & GAMBLE COMPANY (US) 1997-11-05 EP claimed
WO-1996022350-A1 BLEACHING COMPOSITIONS AND ADDITIVES COMPRISING BLEACH ACTIVATORS HAVING ALPHA-MODIFIED LACTAM LEAVING-GROUPS THE PROCTER & GAMBLE COMPANY (US) 1996-07-25 WO claimed
US-4003907-A Δ1 -1-Azacycloalkene-2-carboxylic acids and their production BAYER AKTIENGESELLSCHAFT (DT) 1977-01-18 US claimed
US-20210206725-A1 PIPERLONGUMINE ANALOGUES AND USES THEREOF BIOVENTURES, LLC 2021-07-08 US disclosed
EP-0804530-A1 BLEACHING COMPOSITIONS AND ADDITIVES COMPRISING BLEACH ACTIVATORS HAVING ALPHA-MODIFIED LACTAM LEAVING-GROUPS THE PROCTER & GAMBLE COMPANY (US) 1997-11-05 EP disclosed
US-5635103-A Bleaching compositions and additives comprising bleach activators having alpha-modified lactam leaving-groups THE PROCTER & GAMBLE COMPANY (US) 1997-06-03 US disclosed
WO-1996022350-A1 BLEACHING COMPOSITIONS AND ADDITIVES COMPRISING BLEACH ACTIVATORS HAVING ALPHA-MODIFIED LACTAM LEAVING-GROUPS THE PROCTER & GAMBLE COMPANY (US) 1996-07-25 WO disclosed
EP-0381622-B1 Method for the production of dihalogenobutyraldehydes CIBA GEIGY AG (CH) 1994-03-16 EP disclosed
US-5015780-A Process for the preparation of dihalobutyraldehydes CIBA-GEIGY CORPORATION (US) 1991-05-14 US disclosed
US-4680392-A Substituted caprolactam derivatives as antihypertensives MERCK & CO., INC. (US) 1987-07-14 US disclosed
US-4629787-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS MERCK & CO., INC. (US) 1986-12-16 US disclosed
EP-0046291-B1 SUBSTITUTED CAPROLACTAM DERIVATIVES AS ANTIHYPERTENSIVES, PROCESS FOR PREPARING THEM, PHARMACEUTICAL COMPOSITION CONTAINING THEM, AND INTERMEDIATES MERCK & CO. INC. (US) 1985-12-27 EP disclosed
EP-0046291-A2 Substituted caprolactam derivatives as antihypertensives, process for preparing them, pharmaceutical composition containing them, and intermediates MERCK & CO. INC. (US) 1982-02-24 EP disclosed
US-4044001-A Process for preparing α-chloro-ε-caprolactam ALLIED CHEMICAL CORPORATION (US) 1977-08-23 US disclosed
US-4003907-A Δ1 -1-Azacycloalkene-2-carboxylic acids and their production BAYER AKTIENGESELLSCHAFT (DT) 1977-01-18 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-20210206725-A1 PIPERLONGUMINE ANALOGUES AND USES THEREOF AGER, MCL1, TP53 FKBP5 3236/4885CRBN 1364/4885GRIN1 4767/4885

“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.