SCHEMBL4915722

SCHEMBL4915722

O=C(Nc1ccc(CN2CCOCC2)cc1)Nc1ccc(-n2cccn2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.56
DRD4 P21917 1/20 0.56
DRD3 P35462 1/20 0.56
RAB9A P51151 10/20 0.54
NPC1 O15118 9/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
HTT P42858 1/20 0.54
HIF1A Q16665 3/20 0.52
EPAS1 Q99814 3/20 0.52
HRH3 Q9Y5N1 1/20 0.52
TP53 P04637 3/20 0.51
LMNA P02545 2/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 1/20 0.50

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
SCHEMBL4912591 0.82 NPC1 (0.59) RAB9ANPC1SMN1; SMN2HTTHIF1A
SCHEMBL4915419 0.78 NPC1 (0.78) RAB9ANPC1SMN1; SMN2HTTHIF1A
SCHEMBL4920158 0.77 NOTUM (0.68) RAB9ANPC1SMN1; SMN2HTTTP53
SCHEMBL5175836 0.76 HIF1A (0.53) RAB9ANPC1SMN1; SMN2HTTHIF1A
SCHEMBL4998852 0.76 HRH3 (0.64) RAB9ANPC1SMN1; SMN2HTTHIF1A
SCHEMBL4921397 0.76 HIF1A (0.55) RAB9ANPC1SMN1; SMN2HTTHIF1A
SCHEMBL4922787 0.75 NPC1 (0.65) RAB9ANPC1SMN1; SMN2HIF1AEPAS1
SCHEMBL15932601 0.74 NPC1 (0.69) RAB9ANPC1SMN1; SMN2HTTHIF1A
SCHEMBL31010354 0.74 DRD2 (0.70) DRD2DRD4DRD3SMN1; SMN2HRH3
SCHEMBL13701851 0.73 KMT2A (0.58) SMN1; SMN2HTTKMT2AALDH1A1

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-20120214808-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LIMITED (GB) 2012-08-23 US claimed
US-20080261952-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LTD. (GB) 2008-10-23 US claimed
US-20120214808-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LIMITED (GB) 2012-08-23 US disclosed
US-20080261952-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LTD. (GB) 2008-10-23 US disclosed
EP-1786422-A2 ARYL UREA DERIVATIVES FOR TREATING OBESITY Prosidion Limited (GB) 2007-05-23 EP disclosed
WO-2006018662-A2 ARYL UREA DERIVATIVES FOR TREATING OBESITY PROSIDION LIMITED (GB) 2006-02-23 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-20080261952-A1 Aryl Urea Derivatives for Treating Obesity CNR1, GPR119, UTS2R DRD2 2330/4885DRD4 3220/4885DRD3 2252/4885
US-20120214808-A1 Aryl Urea Derivatives for Treating Obesity CNR1, GPR119, UTS2R DRD2 2330/4885DRD4 3220/4885DRD3 2252/4885

“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.