SCHEMBL6889617

SCHEMBL6889617

Cc1ccc(C(=O)NCCCCCO)cc1

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.76
POLB P06746 2/20 0.69
MMP13 P45452 1/20 0.62
LMNA P02545 1/20 0.62
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
NPC1 O15118 6/20 0.58
RAB9A P51151 5/20 0.58
MAPK1 P28482 1/20 0.57
HDAC3 O15379 3/20 0.56
HDAC1 Q13547 3/20 0.56
ALDH1A1 P00352 2/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
NCOR2 Q9Y618 1/20 0.54
NAAA Q02083 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.54

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
SCHEMBL6892026 1.00 L3MBTL1 (0.76) L3MBTL1POLBMMP13LMNAKMT2A
SCHEMBL14679126 0.98 L3MBTL1 (0.73) L3MBTL1POLBMMP13LMNAKMT2A
SCHEMBL6207746 0.93 L3MBTL1 (0.70) L3MBTL1POLBMMP13LMNAKMT2A
SCHEMBL9489979 0.93 L3MBTL1 (0.86) L3MBTL1POLBMMP13LMNAKMT2A
SCHEMBL29833827 0.91 POLB (0.74) L3MBTL1POLBNPC1RAB9AMAPK1
SCHEMBL24220267 0.86 L3MBTL1 (1.00) L3MBTL1POLBLMNAKMT2AMEN1
SCHEMBL7961787 0.86 L3MBTL1 (1.00) L3MBTL1POLBLMNAKMT2AMEN1
SCHEMBL8208835 0.86 L3MBTL1 (1.00) L3MBTL1POLBLMNAKMT2AMEN1
SCHEMBL764574 0.85 MMP13 (0.81) L3MBTL1POLBMMP13LMNAKMT2A
SCHEMBL11966134 0.85 L3MBTL1 (0.73) L3MBTL1POLBMMP13LMNAKMT2A

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-20040014168-A1 Reagents and methods for library synthesis and screening HOWARD HUGHES MEDICAL INSTITUTE 2004-01-22 US disclosed