SCHEMBL1241981

SCHEMBL1241981

CN(CC1CCCCC1)c1cccc(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.38
OPRM1 P35372 6/20 0.37
OPRK1 P41145 6/20 0.37
CSF1R P07333 2/20 0.35
OPRD1 P41143 3/20 0.35
PTGIR P43119 1/20 0.34
TRPA1 O75762 1/20 0.34
HTR6 P50406 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
EED O75530 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
SCHEMBL1241628 0.86 DAO (0.39) DAOOPRM1OPRK1CSF1RHDAC3
SCHEMBL30936605 0.74 CSF1R (0.41) DAOOPRM1OPRK1CSF1ROPRD1
SCHEMBL6882363 0.74 OPRM1 (0.41) DAOOPRM1OPRK1CSF1ROPRD1
SCHEMBL30936589 0.72 CSF1R (0.40) DAOOPRM1OPRK1CSF1ROPRD1
SCHEMBL6790881 0.72 CES2 (0.38)
SCHEMBL2668587 0.70 ALOX5 (0.41) TRPA1
SCHEMBL4085676 0.70 KMT2A (0.43) OPRM1OPRK1HDAC1HDAC6
SCHEMBL15998771 0.69 TRPV1 (0.46) DAOOPRM1OPRK1CSF1ROPRD1
SCHEMBL5715884 0.69 ESR1 (0.38)
SCHEMBL12204358 0.69 ALOX5 (0.40) TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586614-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2013-11-19 US disclosed
US-20110077234-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2011-03-31 US disclosed
US-7884210-B2 {2-[3-(2-Cyclohex-1-enyl-ethyl)-3-(trans-4-methyl-cyclohexyl)-ureido]-thiazol-5-ylsulfanyl}-acetic acid; for treatment of type 2 diabetes NOVO NORDISK A/S (DK) 2011-02-08 US disclosed
US-20090105482-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
EP-1904467-A1 UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2008-04-02 EP 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-20090105482-A1 Urea Glucokinase Activators GCK, GCKR, HK2 DAO 1452/4885OPRM1 3701/4885OPRK1 1848/4885
US-20110077234-A1 Urea Glucokinase Activators GCK, GCKR, HK2 DAO 1452/4885OPRM1 3701/4885OPRK1 1848/4885

“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.