SCHEMBL2996185

SCHEMBL2996185

Cn1nnc(C2CCCN2C(=O)OCc2ccccc2)n1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 4/20 0.51
SIGMAR1 Q99720 4/20 0.51
AADAT Q8N5Z0 2/20 0.51
ACE2 Q9BYF1 3/20 0.50
PREP P48147 3/20 0.48
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL2996181 1.00 TMEM97 (0.51) TMEM97SIGMAR1AADATACE2PREP
SCHEMBL580802 0.88 SMN1; SMN2 (0.51) TMEM97SIGMAR1ACE2
SCHEMBL2988175 0.86 AADAT (0.53) TMEM97SIGMAR1AADATACE2PREP
SCHEMBL5160860 0.83 TMEM97 (0.55) TMEM97SIGMAR1AADATACE2PREP
SCHEMBL13374850 0.82 AADAT (0.45) TMEM97SIGMAR1AADATACE2PREP
SCHEMBL29277932 0.82 PREP (0.52) TMEM97SIGMAR1AADATACE2PREP
SCHEMBL582341 0.81 SIGMAR1 (0.45) TMEM97SIGMAR1
SCHEMBL2991989 0.80 TMEM97 (0.51) TMEM97SIGMAR1AADATACE2PREP
SCHEMBL2991986 0.80 TMEM97 (0.51) TMEM97SIGMAR1AADATACE2PREP
SCHEMBL15017542 0.80 SMN1; SMN2 (0.57) NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100184991-A1 PREPARATION OF TERAZOLE DERIVATIVES SEDELMEIER GOTTFRIED 2010-07-22 US disclosed
US-20080200687-A1 Preparation of Terazole Derivatives SEDELMEIER GOTTFRIED 2008-08-21 US disclosed
EP-1907378-A1 PREPARATION OF TERAZOLE DERIVATIVES Novartis AG (CH) 2008-04-09 EP disclosed
WO-2007009716-A1 PREPARATION OF TERAZOLE DERIVATIVES NOVARTIS AG (CH) 2007-01-25 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-20080200687-A1 Preparation of Terazole Derivatives TERB1, TALDO1, TERT TMEM97 2959/4885SIGMAR1 1679/4885AADAT 3098/4885
US-20100184991-A1 PREPARATION OF TERAZOLE DERIVATIVES TERB1, TALDO1, TERT TMEM97 2959/4885SIGMAR1 1679/4885AADAT 3098/4885

“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.