SCHEMBL20246782

SCHEMBL20246782

CC1(C)Cc2c(c(N3CCOCC3)nc3sc(C(=O)NC4=CCCC=C4)c(N)c23)CO1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.71
KMT2A Q03164 6/20 0.71
RXFP1 Q9HBX9 3/20 0.69
KDM4E B2RXH2 6/20 0.68
ATM Q13315 2/20 0.68
TDP1 Q9NUW8 1/20 0.68
POLB P06746 2/20 0.66
ALDH1A1 P00352 5/20 0.63
HPGD P15428 4/20 0.63
ALOX15 P16050 2/20 0.63
HSD17B10 Q99714 2/20 0.63
L3MBTL1 Q9Y468 4/20 0.59
GLA P06280 1/20 0.59
GAA P10253 3/20 0.57
MAPT P10636 2/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL20246783 0.91 KDM4E (0.63) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL17175747 0.84 MEN1 (0.86) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL429590 0.82 MEN1 (1.00) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL14955316 0.81 KDM4E (0.85) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL426279 0.81 KDM4E (1.00) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL16451251 0.81 MEN1 (0.75) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL432090 0.80 MEN1 (0.77) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL425244 0.80 ALDH1A1 (0.91) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL429219 0.74 KDM4E (0.74) MEN1KMT2ARXFP1KDM4EATM
SCHEMBL5013137 0.74 KDM4E (0.85) MEN1KMT2ARXFP1KDM4EATM

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
EP-2892525-B1 METHODS OF TREATING MUSCULAR DYSTROPHY UNIV NEVADA RENO (US) 2018-06-13 EP disclosed