SCHEMBL15533591

SCHEMBL15533591

CCOCCOCCOCCOCCOCCOC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 0.45
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 3/20 0.37
HTT P42858 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
TSHR P16473 1/20 0.33
CYP3A4 P08684 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
SCHEMBL25753188 1.00 EPHX2 (0.45) EPHX2MEN1KMT2AALDH1A1HTT
SCHEMBL2084363 0.98 EPHX2 (0.43) EPHX2MEN1KMT2AALDH1A1HTT
SCHEMBL16682526 0.88 EPHX2 (0.44) EPHX2MEN1KMT2AALDH1A1HTT
SCHEMBL482480 0.81 ALDH1A1 (0.41) EPHX2MEN1KMT2AALDH1A1HTT
SCHEMBL15532601 0.80 GRIN2D (0.39) MEN1KMT2AALDH1A1HTTNPSR1
SCHEMBL15532220 0.80 GRIN2D (0.39) MEN1KMT2AALDH1A1HTTNPSR1
SCHEMBL12687856 0.80 MEN1 (0.44) EPHX2MEN1KMT2AALDH1A1HTT
SCHEMBL21997787 0.80 MEN1 (0.44) EPHX2MEN1KMT2AALDH1A1HTT
SCHEMBL15532888 0.80 MEN1 (0.44) EPHX2MEN1KMT2AALDH1A1HTT
SCHEMBL15533296 0.80 GRIN2D (0.39) MEN1KMT2AALDH1A1HTTNPSR1

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-2846784-A1 COMPOUNDS USEFUL FOR PROMOTING PROTEIN DEGRADATION AND METHODS USING SAME Yale University (US) 2015-03-18 EP disclosed
WO-2013170147-A1 COMPOUNDS USEFUL FOR PROMOTING PROTEIN DEGRADATION AND METHODS USING SAME YALE UNIVERSITY (US) 2013-11-14 WO disclosed