SCHEMBL13729971

SCHEMBL13729971

O=C1CCc2nnnn2CC1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
BLM P54132 1/20 0.53
KMT2A Q03164 1/20 0.53

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
Pentylenetetrazol SCHEMBL9838533 0.70 ALDH1A1 (1.00) MEN1ALDH1A1MAPTBLMKMT2A
Pentylenetetrazol SCHEMBL22674 0.70 ALDH1A1 (1.00) MEN1ALDH1A1MAPTBLMKMT2A
Pentylenetetrazol SCHEMBL6407957 0.70 ALDH1A1 (1.00) MEN1ALDH1A1MAPTBLMKMT2A
Pentylenetetrazol SCHEMBL28326199 0.69 ALDH1A1 (0.88) MEN1ALDH1A1MAPTBLMKMT2A
Pentylenetetrazol SCHEMBL10873243 0.68 ALDH1A1 (0.96) MEN1ALDH1A1MAPTBLMKMT2A
Pentylenetetrazol SCHEMBL15057132 0.68 ALDH1A1 (0.96) MEN1ALDH1A1MAPTBLMKMT2A
SCHEMBL13895514 0.65 MEN1 (0.52) MEN1ALDH1A1MAPTBLMKMT2A
Pentylenetetrazol SCHEMBL18501328 0.61 MEN1 (0.47) MEN1ALDH1A1MAPTBLMKMT2A
SCHEMBL10932455 0.60 TRIM24 (0.41) ALDH1A1KMT2A
SCHEMBL4650647 0.60 TRIM24 (0.41) ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951076-B2 Deuterated pentylenetetrazoles for improving cognitive function BALANCE THERAPEUTICS, INC. (US) 2018-04-24 US disclosed
US-9951076-B2 Deuterated pentylenetetrazoles for improving cognitive function BALANCE THERAPEUTICS, INC. (US) 2018-04-24 US disclosed
US-20170044165-A1 PENTYLENETETRAZOLE DERIVATIVES EMORY UNIVERSITY 2017-02-16 US disclosed
US-20170044165-A1 PENTYLENETETRAZOLE DERIVATIVES EMORY UNIVERSITY 2017-02-16 US disclosed
US-20170044165-A1 PENTYLENETETRAZOLE DERIVATIVES EMORY UNIVERSITY 2017-02-16 US disclosed
US-9453020-B2 Substituted pentylenetetrazoles as GABA receptor activity modulators BALANCE THERAPEUTICS, INC. (US) 2016-09-27 US disclosed
US-9453020-B2 Substituted pentylenetetrazoles as GABA receptor activity modulators BALANCE THERAPEUTICS, INC. (US) 2016-09-27 US disclosed
US-9453020-B2 Substituted pentylenetetrazoles as GABA receptor activity modulators BALANCE THERAPEUTICS, INC. (US) 2016-09-27 US disclosed
EP-2705013-B1 PENTYLENETETRAZOLE DERIVATIVES BALANCE THERAPEUTICS INC (US) 2016-03-30 EP disclosed
US-20140343040-A1 PENTYLENETETRAZOLE DERIVATIVES EMORY UNIVERSITY 2014-11-20 US disclosed
US-20140343040-A1 PENTYLENETETRAZOLE DERIVATIVES EMORY UNIVERSITY 2014-11-20 US disclosed
US-20140343040-A1 PENTYLENETETRAZOLE DERIVATIVES EMORY UNIVERSITY 2014-11-20 US disclosed
EP-2705013-A1 PENTYLENETETRAZOLE DERIVATIVES Balance Therapeutics, Inc. (US) 2014-03-12 EP disclosed
WO-2012151343-A1 PENTYLENETETRAZOLE DERIVATIVES BALANCE THERAPEUTICS, INC. (US) 2012-11-08 WO disclosed
WO-2012151343-A1 PENTYLENETETRAZOLE DERIVATIVES BALANCE THERAPEUTICS, INC. (US) 2012-11-08 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-20140343040-A1 PENTYLENETETRAZOLE DERIVATIVES SENP7, ACHE, CHRNA9 MEN1 305/4885ALDH1A1 3228/4885MAPT 111/4885
US-20170044165-A1 PENTYLENETETRAZOLE DERIVATIVES SENP7, ACHE, CHRNA9 MEN1 305/4885ALDH1A1 3228/4885MAPT 111/4885

“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.