SCHEMBL5023485

SCHEMBL5023485

CC(N)(CCCN)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 10/20 0.46
KCNH2 Q12809 2/20 0.46
TAAR1 Q96RJ0 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SLC7A5 Q01650 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAOA P21397 1/20 0.35

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
Hydrochloric Acid SCHEMBL28934888 0.81 CNR1 (0.42) KCNH2CYP3A4SMN1; SMN2MAOA
SCHEMBL5286690 0.76 TAAR1 (0.40) KCNH2TAAR1
SCHEMBL3815410 0.76 KIF11 (0.47) KIF11KCNH2TAAR1CYP3A4CYP2D6
SCHEMBL5675865 0.74 TAAR1 (0.46) TAAR1CYP3A4CYP2D6SMN1; SMN2
SCHEMBL28141859 0.73 CA4 (0.42) TAAR1CYP2D6
SCHEMBL9719486 0.72 TAAR1 (0.45) KIF11KCNH2TAAR1SLC7A5SMN1; SMN2
SCHEMBL11713703 0.71 CA4 (0.43) TAAR1MAOA
SCHEMBL7515025 0.71 CA4 (0.43) TAAR1MAOA
SCHEMBL10760660 0.71 CA4 (0.43) TAAR1MAOA
SCHEMBL5527328 0.70 TAAR1 (0.44) KIF11KCNH2TAAR1CYP3A4SMN1; SMN2

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
EP-1885693-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 Wurster, Siegfried (FI) 2008-02-13 EP claimed
WO-2006123020-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 JUVANTIA PHARMA LTD OY (FI) 2006-11-23 WO claimed
EP-1885693-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 Wurster, Siegfried (FI) 2008-02-13 EP disclosed
WO-2006123020-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 JUVANTIA PHARMA LTD OY (FI) 2006-11-23 WO disclosed