SCHEMBL2659080

SCHEMBL2659080

CC1CCC(NCCCOc2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.57
ALDH1A1 P00352 6/20 0.56
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HTR1B P28222 2/20 0.53
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
DRD2 P14416 3/20 0.50
DRD4 P21917 3/20 0.50
DRD3 P35462 3/20 0.50
HTR1D P28221 1/20 0.50
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL9071936 1.00 KDM4E (0.57) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL2668605 0.95 KDM4E (0.56) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL12204045 0.95 KDM4E (0.56) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL12204180 0.85 KDM4E (0.58) KDM4EALDH1A1KMT2AMEN1CYP1A2
SCHEMBL23074698 0.84 ALDH1A1 (0.70) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL12204135 0.84 ALDH1A1 (0.70) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL2668610 0.82 KDM4E (0.51) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL1240976 0.82 KDM4E (0.51) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL1238758 0.81 ALDH1A1 (0.53) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL8218962 0.79 KDM4E (0.53) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2

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-8362049-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2013-01-29 US disclosed
US-8318778-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2012-11-27 US disclosed
US-20120165375-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2012-06-28 US disclosed
EP-2377856-A1 Urea glucokinase activators NOVO NORDISK A/S (DK) 2011-10-19 EP disclosed
US-20100041711-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2010-02-18 US disclosed
EP-2099777-A1 UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2009-09-16 EP disclosed
WO-2008084044-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2008-07-17 WO disclosed
WO-2007006814-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2007-01-18 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 (2 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-20100041711-A1 Urea Glucokinase Activators GCK, GCKR, HK2 KDM4E 2001/4885ALDH1A1 2703/4885KMT2A 2713/4885
US-20120165375-A1 Urea Glucokinase Activators GCK, GCKR, HK2 KDM4E 2001/4885ALDH1A1 2703/4885KMT2A 2713/4885

“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.