SCHEMBL727807

SCHEMBL727807

CC1CCN(N2CCCC(C)C2)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
PHGDH O43175 1/20 0.35
MGLL Q99685 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ACHE P22303 1/20 0.34
POLB P06746 4/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
RECQL P46063 1/20 0.33
GAA P10253 2/20 0.32
RAB9A P51151 1/20 0.31

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
SCHEMBL726800 0.90 PHGDH (0.33) ALDH1A1LMNAPHGDHMGLLACHE
SCHEMBL3446740 0.90 ALDH1A1 (0.39) ALDH1A1LMNAKDM4EPOLBKMT2A
SCHEMBL10451712 0.88 ALDH1A1 (0.38) ALDH1A1LMNAKDM4EACHEPOLB
Bromide SCHEMBL8688236 0.88 ALDH1A1 (0.38) ALDH1A1LMNAKDM4EPOLBKMT2A
SCHEMBL3301628 0.88 ACHE (0.35) ALDH1A1LMNAPHGDHMGLLACHE
Hydrochloric Acid SCHEMBL7497872 0.88 ALDH1A1 (0.38) ALDH1A1LMNAKDM4EPOLBKMT2A
Hydrochloric Acid SCHEMBL7497886 0.86 ACHE (0.34) ALDH1A1PHGDHMGLLACHEPOLB
Bromide SCHEMBL8688240 0.86 ACHE (0.34) ALDH1A1PHGDHMGLLACHEPOLB
SCHEMBL10982018 0.82 ACHE (0.41) ALDH1A1PHGDHMGLLACHEPOLB
SCHEMBL8802556 0.79 ACHE (0.44) ALDH1A1PHGDHMGLLACHEPOLB

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
JP-4763285-B2 2011-08-31 JP claimed
EP-1521781-B1 PREPARATION OF FUNCTIONALIZED ANIONIC POLYMERIZATION INITIATORS BRIDGESTONE CORP (JP) 2009-03-25 EP claimed
US-7405262-B2 Preparation of functionalized anionic polymerization initiators BRIDGESTONE CORPORATION (JP) 2008-07-29 US claimed
US-20060036050-A1 Preparation of functionalized anionic polymerization initiators BRIDGESTONE CORPORATION (JP) 2006-02-16 US claimed
EP-1521781-A2 PREPARATION OF FUNCTIONALIZED ANIONIC POLYMERIZATION INITIATORS Bridgestone Corporation (JP) 2005-04-13 EP claimed
WO-2004007563-A2 PREPARATION OF FUNCTIONALIZED ANIONIC POLYMERIZATION INITIATORS BRIDGESTONE CORPORATION (JP) 2004-01-22 WO claimed
CN-103460086-B Color composition for color filter and colour filter TOYO INK SC HOLDINGS CO.,LTD. (JP) 2016-05-18 CN disclosed
US-9000070-B2 Mixing of telechelic rubber formulations BRIDGESTONE CORPORATION (JP) 2015-04-07 US disclosed
US-20130116360-A1 MIXING OF TELECHELIC RUBBER FORMULATIONS BRIDGESTONE CORPORATION (JP) 2013-05-09 US disclosed
US-7671139-B1 Functionalized polymers and tires made therefrom BRIDGESTONE CORPORATION (JP) 2010-03-02 US disclosed
EP-1521781-B1 PREPARATION OF FUNCTIONALIZED ANIONIC POLYMERIZATION INITIATORS BRIDGESTONE CORP (JP) 2009-03-25 EP disclosed
US-7405262-B2 Preparation of functionalized anionic polymerization initiators BRIDGESTONE CORPORATION (JP) 2008-07-29 US disclosed
US-20060036050-A1 Preparation of functionalized anionic polymerization initiators BRIDGESTONE CORPORATION (JP) 2006-02-16 US disclosed
EP-1521781-A2 PREPARATION OF FUNCTIONALIZED ANIONIC POLYMERIZATION INITIATORS Bridgestone Corporation (JP) 2005-04-13 EP disclosed
WO-2004007563-A2 PREPARATION OF FUNCTIONALIZED ANIONIC POLYMERIZATION INITIATORS BRIDGESTONE CORPORATION (JP) 2004-01-22 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-20060036050-A1 Preparation of functionalized anionic polymerization initiators PKD1, ALG8, ALG3 ALDH1A1 3921/4885LMNA 2191/4885PHGDH 3570/4885

“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.