SCHEMBL4522502

SCHEMBL4522502

OCc1nc(-c2ccncc2)no1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.71
S1PR1 P21453 2/20 0.61
SMN1; SMN2 Q16637 5/20 0.58
TSHR P16473 4/20 0.58
LMNA P02545 2/20 0.58
NR2F2 P24468 1/20 0.58
STAT3 P40763 1/20 0.58
HTT P42858 1/20 0.58
RAB9A P51151 5/20 0.56
NPC1 O15118 4/20 0.56
RECQL P46063 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
HSD17B10 Q99714 1/20 0.56
KDM4E B2RXH2 1/20 0.54
S1PR3 Q99500 1/20 0.51
MAPT P10636 1/20 0.51

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
SCHEMBL17595755 0.83 NOTUM (1.00) NOTUMS1PR1SMN1; SMN2TSHRRAB9A
SCHEMBL27657411 0.81 S1PR1 (0.61) S1PR1SMN1; SMN2TSHRLMNANR2F2
SCHEMBL4521919 0.81 NOTUM (0.67) NOTUMS1PR1SMN1; SMN2TSHRLMNA
SCHEMBL4288756 0.81 S1PR1 (0.61) S1PR1SMN1; SMN2TSHRLMNANR2F2
SCHEMBL31049642 0.80 NOTUM (0.70) NOTUMSMN1; SMN2TSHRHTTRAB9A
SCHEMBL5356293 0.80 NOTUM (1.00) NOTUMSMN1; SMN2TSHRHTTRAB9A
SCHEMBL14948949 0.80 NOTUM (0.70) NOTUMS1PR1SMN1; SMN2LMNAHTT
SCHEMBL6527881 0.80 NOTUM (0.70) NOTUMSMN1; SMN2TSHRLMNAHTT
SCHEMBL6504714 0.80 S1PR1 (0.65) NOTUMS1PR1LMNAS1PR3MAPT
SCHEMBL7149557 0.79 SMN1; SMN2 (0.60) S1PR1SMN1; SMN2TSHRLMNANR2F2

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-8207147-B2 Heterocyclic derivatives as GPCR receptor agonists PROSIDION LIMITED (GB) 2012-06-26 US disclosed
US-8207147-B2 Heterocyclic derivatives as GPCR receptor agonists PROSIDION LIMITED (GB) 2012-06-26 US disclosed
US-8207147-B2 Heterocyclic derivatives as GPCR receptor agonists PROSIDION LIMITED (GB) 2012-06-26 US disclosed
US-20090281060-A1 HETEROCYCLIC DERIVATIVES AS GPCR RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2009-11-12 US disclosed
US-20090281060-A1 HETEROCYCLIC DERIVATIVES AS GPCR RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2009-11-12 US disclosed
US-20090281060-A1 HETEROCYCLIC DERIVATIVES AS GPCR RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2009-11-12 US disclosed
EP-1711491-A1 HETEROCYCLIC DERIVATIVES AS GPCR RECEPTOR AGONISTS Prosidion Limited (GB) 2006-10-18 EP disclosed
WO-2005061489-A1 HETEROCYCLIC DERIVATIVES AS GPCR RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2005-07-07 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-20090281060-A1 HETEROCYCLIC DERIVATIVES AS GPCR RECEPTOR AGONISTS GPR119, GCGR, GLP1R NOTUM 3957/4885S1PR1 490/4885SMN1; SMN2 2801/4885

“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.