SCHEMBL8106041

SCHEMBL8106041

CCCCC1(OC(=O)/C=C/C(=O)OC2(CCCC)CCCCC2)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.40
CTSK P43235 5/20 0.38
CTSL P07711 4/20 0.38
CTSB P07858 3/20 0.38
HCAR2 Q8TDS4 3/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CETP P11597 4/20 0.34
CTSS P25774 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL17047296 1.00 ATM (0.40) ATMCTSKCTSLCTSBHCAR2
SCHEMBL8101633 0.98 ATM (0.41) ATMCTSKCTSLCTSBHCAR2
SCHEMBL17047299 0.94 HCAR2 (0.46) ATMCTSKCTSLCTSBHCAR2
SCHEMBL17047297 0.94 HCAR2 (0.46) ATMCTSKCTSLCTSBHCAR2
SCHEMBL8099571 0.93 ATM (0.40) ATMCTSKCTSLCTSBHCAR2
SCHEMBL1648754 0.87 TSHR (0.43) ATMCTSKCTSLCTSBMEN1
SCHEMBL29117687 0.87 TSHR (0.43) ATMCTSKCTSLCTSBMEN1
SCHEMBL4401693 0.85 TSHR (0.44) ATMCTSKCTSLCTSBMEN1
SCHEMBL11640875 0.84 MEN1 (0.37) CTSKCTSLCTSBMEN1KMT2A
SCHEMBL28238660 0.82 CTSK (0.45) CTSKCTSLCTSBKMT2ACETP

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
EP-1006130-A1 Fumaric acid diester resin composition, cross-linked fumaric acid diester resin and process NOF CORPORATION (JP) 2000-06-07 EP disclosed