SCHEMBL10039632

SCHEMBL10039632

O=C(O)C1CCN(C(=O)CF)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.54
POLB P06746 2/20 0.51
LMNA P02545 1/20 0.46
RAB9A P51151 2/20 0.42
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.42
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
CREBBP Q92793 1/20 0.40
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.38

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
SCHEMBL13804082 0.82 ALDH1A1 (0.41) L3MBTL1POLBNPC1SMN1; SMN2MAPT
SCHEMBL10039636 0.82 ALDH1A1 (0.41) L3MBTL1POLBLMNANPC1SMN1; SMN2
SCHEMBL6974124 0.81 L3MBTL1 (0.56) L3MBTL1POLBLMNARAB9ANPC1
SCHEMBL1970601 0.81 L3MBTL1 (0.56) L3MBTL1POLBLMNARAB9ANPC1
SCHEMBL3663807 0.80 ALDH1A1 (0.63) L3MBTL1POLBLMNARAB9ANPC1
SCHEMBL20117157 0.79 L3MBTL1 (0.54) L3MBTL1POLBLMNARAB9ANPC1
SCHEMBL7277285 0.79 L3MBTL1 (0.54) L3MBTL1POLBLMNARAB9ANPC1
SCHEMBL2906606 0.79 L3MBTL1 (0.54) L3MBTL1POLBLMNARAB9ANPC1
SCHEMBL4259604 0.79 L3MBTL1 (0.54) L3MBTL1POLBLMNARAB9ANPC1
SCHEMBL5606459 0.79 ALDH1A1 (0.62) L3MBTL1POLBLMNARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130129626-A1 IN VIVO IMAGING AGENTS HAMMERSMITH IMANET LIMITED (GB) 2013-05-23 US disclosed
US-20130129626-A1 IN VIVO IMAGING AGENTS HAMMERSMITH IMANET LIMITED (GB) 2013-05-23 US disclosed
US-20130129625-A1 IN VIVO IMAGING AGENTS HAMMERSMITH IMANET LIMITED (GB) 2013-05-23 US disclosed
US-20130129625-A1 IN VIVO IMAGING AGENTS HAMMERSMITH IMANET LIMITED (GB) 2013-05-23 US disclosed
EP-2125038-B1 RADIOACTIVE PET AGENTS FOR IMAGING CCR5 IN VIVO GE HEALTHCARE LTD (GB) 2012-05-02 EP disclosed
US-20110129419-A1 IN VIVO IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2011-06-02 US disclosed
US-20110129419-A1 IN VIVO IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2011-06-02 US disclosed
WO-2008075040-A2 IN VIVO IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2008-06-26 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 (3 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-20110129419-A1 IN VIVO IMAGING AGENTS CCR5, CCR2, CX3CR1 L3MBTL1 1414/4885POLB 4056/4885LMNA 2853/4885
US-20130129625-A1 IN VIVO IMAGING AGENTS CCR5, CCR2, CX3CR1 L3MBTL1 1414/4885POLB 4056/4885LMNA 2853/4885
US-20130129626-A1 IN VIVO IMAGING AGENTS CCR5, CCR2, CX3CR1 L3MBTL1 1414/4885POLB 4056/4885LMNA 2853/4885

“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.