SCHEMBL5807645

SCHEMBL5807645

C#CCNC1(N)CCc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.40
MAOB P27338 6/20 0.39
MAOA P21397 4/20 0.38
BCHE P06276 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
ACHE P22303 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR6 P50406 1/20 0.38
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
HTR2A P28223 1/20 0.34

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
SCHEMBL7341859 0.78 MAOB (0.38) KDM1AMAOBMAOABCHEADRA2B
SCHEMBL4348712 0.78 MAOB (0.38) KDM1AMAOBMAOABCHEADRA2B
SCHEMBL7947368 0.78 MAOB (0.41) KDM1AMAOBMAOABCHEADRA2B
SCHEMBL6277987 0.73 MAOB (0.34) KDM1AMAOBMAOABCHEADRA2B
SCHEMBL2146984 0.72 KDM1A (0.42) KDM1AMAOBMEN1KMT2ASIGMAR1
SCHEMBL5960895 0.72 KDM1A (0.42) KDM1AMAOBMEN1KMT2ASIGMAR1
SCHEMBL302419 0.72 KDM1A (0.42) KDM1AMAOBMEN1KMT2ASIGMAR1
SCHEMBL29453777 0.72 KDM1A (0.42) KDM1AMAOBMEN1KMT2ASIGMAR1
Hydrochloric Acid SCHEMBL1970466 0.71 KDM1A (0.41) KDM1AMAOBMEN1KMT2ASIGMAR1
Hydrochloric Acid SCHEMBL27310401 0.71 KDM1A (0.41) KDM1AMAOBMEN1KMT2ASIGMAR1

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
WO-2006014968-A2 PROPARGYL NITROXYDES AND INDANYL NITROXIDES AND THEIR USE FOR THE TREATMENT OF NEUROLOGIC DISEASES AND DISORDERS TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2006-02-09 WO disclosed
US-20060025446-A1 Propargyl nitroxides and indanyl nitroxides and their use for the treatment of neurologic diseases and disorders TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2006-02-02 US disclosed
WO-2005084205-A2 DIAMINO THIAZOLOINDAN DERIVATIVES AND THEIR USE TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2005-09-15 WO disclosed
US-20050197365-A1 Diamino thiazoloindan derivatives and their use TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2005-09-08 US 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-20060025446-A1 Propargyl nitroxides and indanyl nitroxides and their use for the treatment of neurologic diseases and disorders CBR1, NR1H2, NR1H3 KDM1A 2253/4885MAOB 996/4885MAOA 1371/4885
US-20050197365-A1 Diamino thiazoloindan derivatives and their use RTN3, RTN4, DRD4 KDM1A 4198/4885MAOB 174/4885MAOA 207/4885

“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.