SCHEMBL6419557

SCHEMBL6419557

CCCCCCCCCCCCNC(=O)[C@H](N)CO

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.71
RRM1 P23921 1/20 0.70
GNAI3 P08754 1/20 0.66
GNAO1 P09471 1/20 0.66
GNAI1 P63096 1/20 0.66
S1PR1 P21453 6/20 0.60
S1PR3 Q99500 6/20 0.60
S1PR2 O95136 5/20 0.60
S1PR5 Q9H228 4/20 0.60
EPHX1 P07099 5/20 0.53
SPHK1 Q9NYA1 2/20 0.50
TLR2 O60603 1/20 0.50
NOD1 Q9Y239 1/20 0.50
NAAA Q02083 1/20 0.50

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
SCHEMBL248428 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL671932 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL15662048 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL506841 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL15662046 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL23001174 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL506842 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL17817201 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL21367553 1.00 DPP7 (0.71) DPP7RRM1GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL506235 0.98 DPP7 (0.69) DPP7RRM1GNAI3GNAO1GNAI1

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
US-20050159488-A1 D-serine transport antagonist for treating psychosis DR. DANIEL JAVITT 2005-07-21 US claimed
US-20020183390-A1 D-serine transport antagonist for treating psychosis DR. DANIEL JAVITT 2002-12-05 US claimed
US-20050159488-A1 D-serine transport antagonist for treating psychosis DR. DANIEL JAVITT 2005-07-21 US disclosed
US-20020183390-A1 D-serine transport antagonist for treating psychosis DR. DANIEL JAVITT 2002-12-05 US disclosed