SCHEMBL17617873

SCHEMBL17617873

COP(=O)(CCc1ccc2ccc3ccc(CCP(=O)(OC)OC)nc3c2n1)OC

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.41
CCR1 P32246 3/20 0.39
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
PARP1 P09874 1/20 0.31
BTN3A1 O00481 1/20 0.31
RAB9A P51151 1/20 0.30
CCR5 P51681 1/20 0.30
DHFR P00374 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
SCHEMBL17617875 0.92 CCR1 (0.38) PDE10ACCR1MTNR1AMTNR1BPARP1
SCHEMBL17617876 0.87 CCR1 (0.39) PDE10ACCR1DHFR
SCHEMBL17617872 0.81 CCR1 (0.42) PDE10ACCR1PARP1RAB9ACCR5
SCHEMBL17617871 0.81 S1PR3 (0.35) PDE10ACCR1
SCHEMBL18380194 0.80 S1PR1 (0.34) PDE10ACCR1
SCHEMBL7096844 0.75 KDM1A (0.35) PARP1BTN3A1
SCHEMBL17617874 0.75 PGK1 (0.49) PDE10ACCR1PARP1
SCHEMBL9106810 0.70 HRH3 (0.51) RAB9A
SCHEMBL7292178 0.66 TSHR (0.50) BTN3A1RAB9A
SCHEMBL432244 0.65 CCR1 (0.54) PDE10ACCR1PARP1RAB9ACCR5

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
US-9548373-B2 Nonvolatile semiconductor memory device KABUSHIKI KAISHA TOSHIBA (JP) 2017-01-17 US disclosed
US-20160087067-A1 NONVOLATILE SEMICONDUCTOR MEMORY DEVICE KABUSHIKI KAISHA TOSHIBA (JP) 2016-03-24 US disclosed