SCHEMBL9870972

SCHEMBL9870972

CC1(C)CC(OOCc2ccccc2)CC(C)(C)N1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
SLC2A1 P11166 1/20 0.44
EZH2 Q15910 2/20 0.42
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
RAD52 P43351 1/20 0.39
GFER P55789 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM1A O60341 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HTT P42858 1/20 0.37
OPRM1 P35372 2/20 0.36
OPRL1 P41146 2/20 0.36
POLB P06746 1/20 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
SCHEMBL451933 0.83 GAA (0.50) GAASLC2A1EZH2KMT2AALDH1A1
Hydrochloric Acid SCHEMBL27993290 0.82 OPRM1 (0.49) GAASLC2A1EZH2KMT2AALDH1A1
SCHEMBL8399574 0.78 ALDH1A1 (0.40) GAAKMT2AALDH1A1HTTOPRM1
SCHEMBL8879727 0.75 TSHR (0.46) OPRM1OPRL1TSHR
SCHEMBL25309783 0.74 GAA (0.48) GAASLC2A1EZH2KMT2AALDH1A1
SCHEMBL565118 0.74 GAA (0.42) GAASLC2A1EZH2KMT2AALDH1A1
SCHEMBL12532630 0.72 TSHR (0.60) GAAKMT2AALDH1A1MEN1MAPT
SCHEMBL17640019 0.72 OPRM1 (0.41) GAASLC2A1EZH2OPRM1OPRL1
SCHEMBL27512721 0.72 TSHR (0.43) KMT2AALDH1A1MEN1KDM4EOPRM1
SCHEMBL8978495 0.71 MEN1 (0.40) KMT2AALDH1A1MEN1ALOX15KDM4E

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-5015678-A Light stabilized polymers by the addition of N-hydoxyamines CIBA-GEIGY CORPORATION (US) 1991-05-14 US disclosed