SCHEMBL2649029

SCHEMBL2649029

Nc1ncc(-n2ccnc2)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
MAPT P10636 1/20 0.43
CYP3A4 P08684 6/20 0.38
CYP2A6 P11509 1/20 0.38
IDO1 P14902 2/20 0.37
NOS1 P29475 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.36
ENPP2 Q13822 1/20 0.35
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35
NOTUM Q6P988 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
TSHR P16473 2/20 0.33
CYP19A1 P11511 1/20 0.33
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL18013070 0.73 MAPT (0.54) LMNAMAPTCYP3A4CYP2A6ENPP2
SCHEMBL28061806 0.71 CYP3A4 (0.50) LMNAMAPTCYP3A4CYP2A6IDO1
SCHEMBL27807048 0.71 LIMK1 (0.48) LMNAMAPTCYP3A4CYP2A6IDO1
SCHEMBL19031368 0.69 IDO1 (0.48) LMNAMAPTCYP3A4CYP2A6IDO1
SCHEMBL8150666 0.68 LMNA (0.44) LMNAMAPTCYP3A4CYP2A6IDO1
SCHEMBL4878557 0.67 LMNA (0.56) LMNAMAPTCYP3A4CYP2A6IDO1
SCHEMBL30753599 0.67 LMNA (0.56) LMNAMAPTCYP3A4CYP2A6IDO1
SCHEMBL184732 0.67 TDO2 (0.42) LMNAMAPTNOS1NOTUMADORA2A
SCHEMBL29241982 0.64 CYP3A4 (0.42) LMNAMAPTCYP3A4CYP2A6IDO1
SCHEMBL18708523 0.64 LMNA (0.44) LMNAMAPTCYP3A4CYP2A6IDO1

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-7582769-B2 Dicycloalkyl urea glucokinase activators NOVO NORDISK A/S (DK) 2009-09-01 US disclosed
US-20090118501-A1 Dicycloalkyl Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2009-05-07 US disclosed
EP-1904466-A1 DICYCLOALKYL UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2008-04-02 EP disclosed
WO-2007006760-A1 DICYCLOALKYL 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 (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-20090118501-A1 Dicycloalkyl Urea Glucokinase Activators GCK, GCKR, UCK2 LMNA 4018/4885MAPT 2197/4885CYP3A4 1445/4885

“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.