SCHEMBL9696852

SCHEMBL9696852

CCOC(=O)CC12CCN(CC1)C2

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
GAA P10253 2/20 0.39
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
ALOX15 P16050 2/20 0.37
ALDH1A1 P00352 2/20 0.36
TRPA1 O75762 1/20 0.36
TSHR P16473 3/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
FDFT1 P37268 1/20 0.34
ELANE P08246 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL2422852 0.89 KMT2A (0.42) KMT2AL3MBTL1GAAMGAMSI
Hydrochloric Acid SCHEMBL8126733 0.81 KMT2A (0.38) KMT2AL3MBTL1GAAMGAMSI
SCHEMBL22777434 0.75 TSHR (0.42) KMT2AL3MBTL1GAAMGAMSI
SCHEMBL22784325 0.72 GRM1 (0.38) KMT2AALDH1A1TSHRLMNAPOLB
SCHEMBL592258 0.70 OPRM1 (0.40)
SCHEMBL31618421 0.69 LMNA (0.50) KMT2AL3MBTL1GAAMGAMSI
Bromide SCHEMBL6628170 0.69 OPRM1 (0.39)
SCHEMBL597365 0.69 KMT2A (0.51) KMT2AL3MBTL1GAAMGAMSI
SCHEMBL16276877 0.69 GAA (0.48) KMT2AL3MBTL1GAAMGAMSI
SCHEMBL380983 0.69 GAA (0.48) KMT2AL3MBTL1GAAMGAMSI

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
US-5091397-A Cognition activators BEECHAM GROUP P.L.C. (GB) 1992-02-25 US disclosed
EP-0363085-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-04-11 EP disclosed