SCHEMBL4513166

SCHEMBL4513166

O=C(O)N1CCC(c2nc(-c3ccncc3)no2)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.73
▸ LMNA P02545 4/20 0.73
▸ TSHR P16473 4/20 0.73
▸ EPHX2 P34913 1/20 0.64
▸ KCNH2 Q12809 1/20 0.64
▸ CYP1A2 P05177 1/20 0.63
▸ CYP3A4 P08684 1/20 0.63
▸ CYP2D6 P10635 1/20 0.63
▸ CYP2C9 P11712 1/20 0.63
▸ CYP2C19 P33261 1/20 0.63
▸ TUBB4A P04350 3/20 0.57
▸ TUBB P07437 3/20 0.57
▸ TUBA3C P0DPH7 3/20 0.57
▸ TUBA1B P68363 3/20 0.57
▸ TUBA4A P68366 3/20 0.57
▸ TUBB4B P68371 3/20 0.57
▸ TUBB3 Q13509 3/20 0.57
▸ TUBB2A Q13885 3/20 0.57
▸ TUBB8 Q3ZCM7 3/20 0.57
▸ TUBA3E Q6PEY2 3/20 0.57

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
SCHEMBL3241112 0.90 TUBB4A (0.69) SMN1; SMN2LMNATSHREPHX2KCNH2
SCHEMBL6386469 0.87 TUBB4A (0.67) SMN1; SMN2LMNATSHREPHX2KCNH2
SCHEMBL2025938 0.86 LMNA (0.72) SMN1; SMN2LMNATSHRCYP1A2CYP3A4
SCHEMBL2026288 0.85 EPHX2 (0.68) SMN1; SMN2LMNATSHREPHX2KCNH2
SCHEMBL2027525 0.85 LMNA (0.66) SMN1; SMN2LMNATSHREPHX2KCNH2
SCHEMBL2027122 0.84 LMNA (0.54) SMN1; SMN2LMNATSHREPHX2KCNH2
SCHEMBL390059 0.83 LMNA (0.68) SMN1; SMN2LMNATSHREPHX2KCNH2
SCHEMBL25172097 0.83 ALDH1A1 (0.62) SMN1; SMN2LMNATSHRCYP1A2CYP3A4
SCHEMBL2028783 0.83 SMN1; SMN2 (0.55) SMN1; SMN2LMNATSHRTUBB4ATUBB
SCHEMBL392255 0.83 SMN1; SMN2 (0.67) SMN1; SMN2LMNATSHREPHX2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090281060-A1 HETEROCYCLIC DERIVATIVES AS GPCR RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2009-11-12 — — US claimed
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
CN-101420941-A Use of GPR119 receptor agonists for increasing bone mass and for treating osteoporosis, and related combination therapies ARENA PHARM INC (US) 2009-04-29 — — CN disclosed
CN-101332303-A Combination therapy for the treatment of diabetes and conditions related thereto and for the treatment of conditions ameliorated by increasing a blood glp-1 level ARENA PHARM INC (US) 2008-12-31 — — CN 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 SMN1; SMN2 2801/4885LMNA 4276/4885TSHR 134/4885

“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.

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