SCHEMBL8538145

SCHEMBL8538145

NCCCCCCCOc1ccccc1-c1ncc[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.52
CSNK1A1 P48729 1/20 0.44
TYRO3 Q06418 1/20 0.44
DYRK1B Q9Y463 1/20 0.44
SSTR2 P30874 1/20 0.44
SSTR4 P31391 1/20 0.44
PDE5A O76074 8/20 0.43
PDE4A P27815 5/20 0.43
PDE4B Q07343 5/20 0.43
PDE4C Q08493 5/20 0.43
PDE4D Q08499 5/20 0.43
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
MTOR P42345 1/20 0.40
ADK P55263 1/20 0.40
NISCH Q9Y2I1 1/20 0.40
HTR1B P28222 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 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
SCHEMBL8541667 1.00 ADRA1A (0.52) ADRA1ACSNK1A1TYRO3DYRK1BSSTR2
SCHEMBL8615627 0.99 ADRA1A (0.53) ADRA1ACSNK1A1TYRO3DYRK1BSSTR2
SCHEMBL8536843 0.82 ADRA1A (0.49) ADRA1ACSNK1A1TYRO3DYRK1BPDE5A
SCHEMBL8614544 0.82 ADRA1A (0.49) ADRA1ACSNK1A1TYRO3DYRK1BPDE5A
SCHEMBL8541110 0.81 FABP4 (0.49) ADRA1ACSNK1A1TYRO3DYRK1BPDE5A
SCHEMBL8538135 0.81 FABP4 (0.49) ADRA1ACSNK1A1TYRO3DYRK1BPDE5A
SCHEMBL8537029 0.81 ADRA1A (0.50) ADRA1ACSNK1A1TYRO3DYRK1BPDE5A
SCHEMBL8538071 0.80 FABP4 (0.50) ADRA1ACSNK1A1TYRO3DYRK1BPDE5A
SCHEMBL8541523 0.79 ADRA1A (0.54) ADRA1ACSNK1A1TYRO3DYRK1BPDE5A
Hydrochloric Acid SCHEMBL8537266 0.79 ADRA1A (0.44) ADRA1ACSNK1A1TYRO3DYRK1BPDE5A

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
EP-0857171-A2 IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 1998-08-12 EP disclosed
WO-1997015555-A2 IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 1997-05-01 WO disclosed