SCHEMBL10339574

SCHEMBL10339574

O=C(O)/C=C\C(=O)OC1CC2CC1C1CC=CC21

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.44
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HCAR2 Q8TDS4 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
SCHEMBL10339584 0.89 ATM (0.44) ATMNPC1RAB9ANPSR1L3MBTL1
SCHEMBL31661865 0.83 POLB (0.33)
SCHEMBL91435 0.83 POLB (0.33)
SCHEMBL114981 0.78 CHRM2 (0.33) NPC1RAB9ANPSR1L3MBTL1
SCHEMBL18604001 0.78 CHRM2 (0.33) NPC1RAB9ANPSR1L3MBTL1
SCHEMBL17836876 0.78 CHRM2 (0.33) NPC1RAB9ANPSR1L3MBTL1
SCHEMBL19880941 0.77 HCAR2 (0.34) ATMHCAR2
SCHEMBL15744088 0.77 POLB (0.39) ATMRAB9ANPSR1L3MBTL1HCAR2
SCHEMBL17836875 0.74 CHRM2 (0.35)
SCHEMBL1203112 0.74 CHRM2 (0.35)

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
JP-2228316-A None JP disclosed
JP-2228311-A None JP disclosed
JP-H02228311-A PREPARATION OF RESIN AND RESIN COMPOSITION HITACHI CHEM CO LTD 1990-09-11 JP disclosed
JP-H02228316-A PREPARATION OF THERMOSETTING RESIN AND RESIN COMPOSITION HITACHI CHEM CO LTD 1990-09-11 JP disclosed