SCHEMBL8395229

SCHEMBL8395229

O=C1[N]CCCN1CCC1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.36
HPGD P15428 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
TSHR P16473 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CTSD P07339 1/20 0.34
BACE1 P56817 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PIM1 P11309 1/20 0.33
NAAA Q02083 1/20 0.32
CEL P19835 1/20 0.32

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
SCHEMBL8392440 1.00 ACHE (0.36) ACHEHPGDKDM4CTSHRL3MBTL1
SCHEMBL8392789 0.98 ACHE (0.37) ACHEHPGDKDM4CTSHRL3MBTL1
SCHEMBL8392736 0.95 ACHE (0.37) ACHEHPGDKDM4CTSHRLMNA
SCHEMBL8393531 0.93 ACHE (0.38) ACHETSHRLMNANPSR1KDM4E
SCHEMBL8395514 0.92 HPGD (0.36) ACHEHPGDKDM4CTSHRL3MBTL1
SCHEMBL8392721 0.92 HPGD (0.36) ACHEHPGDKDM4CTSHRL3MBTL1
SCHEMBL8395374 0.90 NAAA (0.36) CTSDBACE1NAAACEL
SCHEMBL8392445 0.90 NAAA (0.36) CTSDBACE1NAAACEL
SCHEMBL8393700 0.90 ACHE (0.35) ACHEHPGDKDM4CTSHRL3MBTL1
SCHEMBL8396156 0.89 NAAA (0.34) CTSDBACE1NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed
EP-0392317-B1 Benzimidazoles, drugs containing these compounds and process for their preparation THOMAE GMBH DR K (DE) 1996-01-03 EP disclosed
EP-0470543-A1 Heterocyclic imidazoles, remedies containing them and processes for their preparation Dr. Karl Thomae GmbH (DE) 1992-02-12 EP disclosed
EP-0392317-A2 Benzimidazoles, drugs containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1990-10-17 EP disclosed