SCHEMBL8505608

SCHEMBL8505608

CCCCOCN1C2CCC1CC(=O)C2

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
TSHR P16473 3/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NPC1 O15118 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 2/20 0.31
CRBN Q96SW2 1/20 0.31
CYP1A2 P05177 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
SCHEMBL7808250 0.74 MAPK1 (0.41) MAPK1MEN1KMT2AHSD17B10CYP3A4
SCHEMBL5415021 0.74 MAPK1 (0.48) MAPK1MEN1KMT2AALDH1A1HPGD
SCHEMBL5071115 0.73 MAPK1 (0.46) MAPK1MEN1KMT2A
SCHEMBL5317376 0.72 SMN1; SMN2 (0.42) MAPK1MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL6997536 0.71 MAPK1 (0.38) MAPK1MEN1KMT2A
SCHEMBL10215944 0.71 SMN1; SMN2 (0.47) SMN1; SMN2TSHRUSP2ALDH1A1POLB
SCHEMBL7804700 0.69 MAPK1 (0.44) MAPK1MEN1KMT2AALDH1A1
SCHEMBL10215961 0.69 CYP1A2 (0.40) SMN1; SMN2TSHRALDH1A1NPC1CYP3A4
SCHEMBL124787 0.67 GAA (0.42) SMN1; SMN2TSHRUSP2ALDH1A1POLB
SCHEMBL7748021 0.66 NPC1 (0.37) SMN1; SMN2TSHRALDH1A1NPC1CYP3A4

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
EP-0946553-A1 8-AZABICYCLO 3.2.1]OCTANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES ZENECA LIMITED (GB) 1999-10-06 EP disclosed
WO-1998025923-A1 8-AZABICYCLO[3.2.1]OCTANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES ZENECA LIMITED (GB) 1998-06-18 WO disclosed