SCHEMBL26698016

SCHEMBL26698016

Cn1c(=O)c(=O)n(C2CCNCC2)c2cc(Cl)ccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.45
SLC6A4 P31645 2/20 0.45
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
HTR2A P28223 1/20 0.41
DRD3 P35462 1/20 0.41
HPD P32754 3/20 0.40
MAT2A P31153 1/20 0.39
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
HSD11B1 P28845 1/20 0.37
KCNH2 Q12809 1/20 0.37
PIK3CA P42336 4/20 0.37
PRKDC P78527 4/20 0.37
MTOR P42345 2/20 0.36
TNF P01375 1/20 0.36
LITAF Q99732 1/20 0.36
PLD1 Q13393 1/20 0.36
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL26698009 0.95 DRD2 (0.51) DRD2SLC6A4HTR1AADRA2AHTR2A
SCHEMBL4712560 0.88 DRD2 (0.58) DRD2SLC6A4HTR1AADRA2AHTR2A
SCHEMBL26698035 0.84 OPRM1 (0.37) HPDPIK3CAPRKDCMTORPLD1
SCHEMBL26698037 0.84 OPRM1 (0.37) HPDPIK3CAPRKDCMTORPLD1
SCHEMBL11847280 0.82 DRD2 (0.65) DRD2SLC6A4HTR1AADRA2AHTR2A
SCHEMBL26697994 0.81 PARP1 (0.44) HTR2AHTR2CLMNAKDM4EALDH1A1
SCHEMBL30770199 0.81 PARP1 (0.44) HTR2AHTR2CLMNAKDM4EALDH1A1
SCHEMBL26698022 0.78 OPRM1 (0.37) DRD2SLC6A4HPDPIK3CAPRKDC
SCHEMBL26671825 0.78 CCR3 (0.44) DRD2SLC6A4PIK3CAMTORHTR6
SCHEMBL24478284 0.78 HSD17B10 (0.50) HSD11B1PIK3CAPRKDCMTORTNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023229375-A1 HETEROCYCLIC COMPOUND AS DIACYLGLYCEROL KINASE INHIBITOR AND USE THEREOF 주식회사 엘지화학 2023-11-30 WO disclosed