SCHEMBL2265023

SCHEMBL2265023

Cc1cc2cc(N)ccc2n1CCC1CCCN1C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.46
NOS1 P29475 8/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
HTR6 P50406 5/20 0.40
NOS3 P29474 6/20 0.39
NOS2 P35228 6/20 0.39
KCNH2 Q12809 1/20 0.39
PLK1 P53350 1/20 0.39
BRPF1 P55201 1/20 0.39
TP53 P04637 1/20 0.38
DRD2 P14416 1/20 0.38
HTR2A P28223 1/20 0.38
HTR7 P34969 1/20 0.38

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
SCHEMBL12367568 0.81 NOS3 (0.56) ADRA2ANOS1CHRNB2CHRNA4HTR6
SCHEMBL12367467 0.81 NOS3 (0.56) ADRA2ANOS1CHRNB2CHRNA4HTR6
SCHEMBL2264780 0.80 OPRM1 (0.54) ADRA2ACHRNB2CHRNA4
SCHEMBL8532288 0.80 ADRA2A (0.65) ADRA2AHTR6TP53DRD2HTR2A
SCHEMBL12391647 0.78 NOS1 (0.40) ADRA2ANOS1CHRNB2CHRNA4NOS3
SCHEMBL2263565 0.78 NOS3 (0.56) ADRA2ANOS1HTR6NOS3NOS2
SCHEMBL2267374 0.77 OPRM1 (0.47) ADRA2ACHRNB2CHRNA4HTR6PLK1
SCHEMBL1122077 0.76 NOS3 (0.57) ADRA2ANOS1CHRNB2CHRNA4HTR6
SCHEMBL2074890 0.76 BRPF1 (0.44) BRPF1TP53DRD2
SCHEMBL12367469 0.75 NOS1 (0.43) ADRA2ANOS1CHRNB2CHRNA4HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010527-B1 1,5 AND 3,6- SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY NEURAXON INC (CA) 2013-08-14 EP disclosed
US-7989447-B2 1,5 and 3,6-substituted indole compounds having NOS inhibitory activity NEURAXON, INC. (CA) 2011-08-02 US disclosed
US-7989447-B2 1,5 and 3,6-substituted indole compounds having NOS inhibitory activity NEURAXON, INC. (CA) 2011-08-02 US disclosed
US-7989447-B2 1,5 and 3,6-substituted indole compounds having NOS inhibitory activity NEURAXON, INC. (CA) 2011-08-02 US disclosed
EP-2010527-A1 1,5 AND 3,6- SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY Neuraxon Inc. (CA) 2009-01-07 EP disclosed
US-20070254940-A1 1,5 And 3,6- substituted indole compounds having NOS inhibitory activity NEURAXON, INC. (CA) 2007-11-01 US disclosed
US-20070254940-A1 1,5 And 3,6- substituted indole compounds having NOS inhibitory activity NEURAXON, INC. (CA) 2007-11-01 US disclosed
US-20070254940-A1 1,5 And 3,6- substituted indole compounds having NOS inhibitory activity NEURAXON, INC. (CA) 2007-11-01 US disclosed
WO-2007118314-A1 1,5 AND 3,6- SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY NEURAXON, INC. (CA) 2007-10-25 WO disclosed
WO-2007118314-A1 1,5 AND 3,6- SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY NEURAXON, INC. (CA) 2007-10-25 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 (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-20070254940-A1 1,5 And 3,6- substituted indole compounds having NOS inhibitory activity NOS1, NOS3, NOS2 ADRA2A 1551/4885NOS1 1/4885CHRNB2 423/4885

“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.