SCHEMBL3244902

SCHEMBL3244902

Cc1ccc(-c2ccc(OCCN3CCCC3=O)nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
POLB P06746 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
CTSS P25774 3/20 0.41
AKT1 P31749 1/20 0.40
AKT2 P31751 1/20 0.40
EGFR P00533 1/20 0.40
SYK P43405 1/20 0.40
KIT P10721 1/20 0.40
KDR P35968 1/20 0.40
FLT3 P36888 1/20 0.40
MCHR1 Q99705 1/20 0.40
CCNC P24863 1/20 0.39
CDK8 P49336 1/20 0.39
PDK2 Q15119 1/20 0.39
CTSK P43235 1/20 0.39
NLRP3 Q96P20 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL22336931 0.90 MEN1 (0.52) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL23405901 0.81 MEN1 (0.52) MEN1KMT2APOLBCTSSAKT1
SCHEMBL29744200 0.81 MEN1 (0.52) MEN1KMT2APOLBCTSSAKT1
SCHEMBL4590127 0.80 KMT2A (0.51) MEN1KMT2APOLBCTSSAKT1
SCHEMBL1926584 0.80 KMT2A (0.52) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL20163396 0.80 MEN1 (0.52) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL2227979 0.80 KMT2A (0.52) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL4590112 0.80 MEN1 (0.48) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL13946706 0.79 POLB (0.56) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL29743939 0.78 MEN1 (0.48) MEN1KMT2APOLBCTSSAKT1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO claimed
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO disclosed
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO disclosed