SCHEMBL8394063

SCHEMBL8394063

CCCCOCC(O)CN1CCN(CC(O)COCCCC)CCN(CC(O)COCCCC)CC1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 4/20 0.71
ALDH1A1 P00352 3/20 0.71
KDM4E B2RXH2 3/20 0.71
ALOX15 P16050 1/20 0.71
HTT P42858 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
KMT2A Q03164 6/20 0.47
GLA P06280 1/20 0.46
TSHR P16473 1/20 0.46
MEN1 O00255 4/20 0.46
LMNA P02545 3/20 0.46
MAPK1 P28482 2/20 0.46
RAB9A P51151 2/20 0.46
HSP90AB1 P08238 1/20 0.44
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 1/20 0.43
LPAR5 Q9H1C0 1/20 0.42

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
SCHEMBL23673724 1.00 USP2 (0.71) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL10005231 0.93 KDM4E (0.64) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL8352923 0.89 ALDH1A1 (0.59) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL12761114 0.89 USP2 (0.59) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL11154511 0.87 KDM4E (0.58) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL9751080 0.86 ALDH1A1 (0.57) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL8195163 0.86 HTT (0.59) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL8193195 0.86 HTT (0.59) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL18181946 0.85 SMN1; SMN2 (0.59) USP2ALDH1A1KDM4EALOX15HTT
SCHEMBL13924017 0.85 KDM4E (0.55) USP2ALDH1A1KDM4EALOX15HTT

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
US-5874573-A Compounds with chelation affinity and selectivity for first transition series elements: use in medical therapy CONCAT, INC. (US) 1999-02-23 US claimed