SCHEMBL13469006

SCHEMBL13469006

N#Cc1ccc(COc2ccc(C3C[C@@H]3NCC(N)=O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.56
KDM1A O60341 16/20 0.55
MAOB P27338 12/20 0.55
MAOA P21397 9/20 0.55
RAB9A P51151 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
SCHEMBL1667830 1.00 KCNH2 (0.56) KCNH2KDM1AMAOBMAOARAB9A
SCHEMBL1667828 1.00 KCNH2 (0.56) KCNH2KDM1AMAOBMAOARAB9A
Hydrochloric Acid SCHEMBL13277807 0.99 KCNH2 (0.55) KCNH2KDM1AMAOBMAOARAB9A
Hydrochloric Acid SCHEMBL13277806 0.99 KCNH2 (0.55) KCNH2KDM1AMAOBMAOARAB9A
SCHEMBL11903562 0.90 KDM1A (0.59) KCNH2KDM1AMAOBMAOARAB9A
SCHEMBL11903561 0.90 KDM1A (0.59) KCNH2KDM1AMAOBMAOARAB9A
SCHEMBL1667796 0.88 KDM1A (0.54) KCNH2KDM1AMAOBMAOARAB9A
SCHEMBL1667652 0.87 KCNH2 (0.59) KCNH2KDM1AMAOBMAOA
SCHEMBL1667651 0.87 KCNH2 (0.59) KCNH2KDM1AMAOBMAOA
SCHEMBL13453250 0.87 KCNH2 (0.59) KCNH2KDM1AMAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946296-B2 Substituted heteroaryl- and aryl-cyclopropylamine acetamides and their use ORYZON GENOMICS S.A. (ES) 2015-02-03 US disclosed
US-20120264823-A1 SUBSTITUTED HETEROARYL- AND ARYL-CYCLOPROPYLAMINE ACETAMIDES AND THEIR USE ORYZON GENOMICS S.A. 2012-10-18 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 (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-20120264823-A1 SUBSTITUTED HETEROARYL- AND ARYL-CYCLOPROPYLAMINE ACETAMIDES AND THEIR USE CBR1, CNR1, CBR3 KCNH2 1511/4885KDM1A 877/4885MAOB 569/4885

“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.