SCHEMBL7724563

SCHEMBL7724563

Cn1c(O)cnc1NC=O

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.30
AHR P35869 1/20 0.30
POLB P06746 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
LIMK1 P53667 1/20 0.30

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
SCHEMBL9885812 0.67
SCHEMBL3540174 0.61
SCHEMBL7453798 0.61
SCHEMBL29011264 0.61 ALDH1A1 (0.41)
SCHEMBL8918954 0.61 KDM4E (0.30)
SCHEMBL28195114 0.60
SCHEMBL2785733 0.60 ALDH1A1 (0.30)
SCHEMBL18611181 0.60
SCHEMBL28497472 0.58
SCHEMBL28047875 0.58 ALDH1A1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355805-B1 MULTIBINDING COMPOUNDS USEFUL IN TREATMENT AND PREVENTION OF METABOLIC DISORDERS SUCH AS OBESITY AND DIABETES ADVANCED MEDICINE, INC. 2002-03-12 US disclosed
EP-1085894-A1 BETA 3-ADRENERGIC RECEPTOR AGONISTS Advanced Medicine, Inc. (US) 2001-03-28 EP disclosed
WO-1999064053-A1 β3-ADRENERGIC RECEPTOR AGONISTS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed