SCHEMBL1241022

SCHEMBL1241022

Fc1ccc(NCC2CCCC2)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 2/20 0.54
PLA2G1B P04054 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
ATG4B Q9Y4P1 1/20 0.49
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
TRPA1 O75762 1/20 0.45
MAPT P10636 4/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.42
SHMT2 P34897 1/20 0.42
POLB P06746 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL1241519 0.85 NPC1 (0.45) SOS1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL1565984 0.85 MEN1 (0.45) SOS1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL30345195 0.84 SOS1 (0.48) SOS1PLA2G1BCYP1A2CYP3A4CYP2D6
SCHEMBL30345260 0.84 SOS1 (0.48) SOS1PLA2G1BCYP1A2CYP3A4CYP2D6
SCHEMBL1241991 0.83 NPC1 (0.48) SOS1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL1241081 0.81 BACE1 (0.46) SOS1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL13493867 0.79 APP (0.39) SOS1CYP3A4ALDH1A1TSHRNPC1
SCHEMBL6504362 0.79 HTT (0.51) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL1240987 0.78 JAK2 (0.48)
SCHEMBL22414314 0.78 NPC1 (0.47) CYP2C9CYP2C19ALDH1A1SMN1; SMN2KMT2A

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 SOS1 4847/4885PLA2G1B 2828/4885CYP1A2 1207/4885
US-20110077234-A1 Urea Glucokinase Activators GCK, GCKR, HK2 SOS1 4847/4885PLA2G1B 2828/4885CYP1A2 1207/4885

“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.