SCHEMBL46380

SCHEMBL46380

CON1CCC(N)(N(CC2CCCO2)C(=O)Cc2c(C)cc(C)cc2C)CC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
GAA P10253 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 4/20 0.36
OXTR P30559 2/20 0.35
AVPR1A P37288 2/20 0.35

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
SCHEMBL46352 0.87 POLB (0.41) POLBTP53MAPTALDH1A1KDM4E
SCHEMBL15032125 0.86 ALDH1A1 (0.39) POLBTP53MAPTALDH1A1KDM4E
SCHEMBL46056 0.79 MEN1 (0.37) POLBALDH1A1KDM4EHSD17B10SMN1; SMN2
SCHEMBL46114 0.78 MEN1 (0.33) POLBALDH1A1KMT2AMEN1
SCHEMBL46055 0.77 MEN1 (0.33) ALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL12574778 0.76 MEN1 (0.30) KMT2AMEN1
SCHEMBL12574771 0.76 ALDH1A1 (0.36) POLBMAPTALDH1A1KDM4EKMT2A
SCHEMBL36994 0.73 ALDH1A1 (0.37) POLBMAPTALDH1A1KMT2AMEN1
SCHEMBL19956388 0.73 ALDH1A1 (0.34) POLBTP53MAPTALDH1A1KDM4E
SCHEMBL19140076 0.72 ALDH1A1 (0.38) POLBMAPTALDH1A1KMT2AMEN1

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
WO-2011151249-A2 METHOD OF CONTROLLING NEONICOTINOID RESISTANT HEMIPTERA SYNGENTA PARTICIPATIONS AG (CH) 2011-12-08 WO disclosed
WO-2010066780-A1 SPIROHETEROCYCLIC N-OXYPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-06-17 WO disclosed