SCHEMBL7709245

SCHEMBL7709245

Brc1cccnc1OC1CNC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.45
HTR1A P08908 3/20 0.45
CHRM1 P11229 1/20 0.38
SLC6A4 P31645 8/20 0.38
HTR6 P50406 1/20 0.37
SLC6A3 Q01959 2/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36

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 SCHEMBL15134957 0.98 SLC6A2 (0.44) SLC6A2HTR1ACHRM1SLC6A4HTR6
SCHEMBL24344501 0.84 ALOX5AP (0.40)
SCHEMBL15917169 0.83 NMT1 (0.46) SLC6A2HTR1ASLC6A4SLC6A3CHRNB2
SCHEMBL18103938 0.81 PDE10A (0.36)
SCHEMBL31441792 0.81 LRRK2 (0.43)
SCHEMBL7702753 0.81 LRRK2 (0.43)
SCHEMBL28083358 0.81 LRRK2 (0.43)
SCHEMBL2634568 0.79 ALOX5AP (0.36)
SCHEMBL20071111 0.79 SSTR4 (0.45) SLC6A2HTR1ACHRM1SLC6A4
SCHEMBL12030214 0.79 ALOX5AP (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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376450-B2 Heteroaryloxyheterocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2016-06-28 US disclosed
US-9376450-B2 Heteroaryloxyheterocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2016-06-28 US disclosed
US-8497265-B2 Heteroaryloxyheterocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2013-07-30 US disclosed
US-8497265-B2 Heteroaryloxyheterocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2013-07-30 US disclosed
WO-2011143495-A1 HETEROARYLOXYHETEROCYCLYL COMPOUNDS AS PDE10 INHIBITORS AMGEN INC. (US) 2011-11-17 WO disclosed