SCHEMBL4608538

SCHEMBL4608538

[CH2]Cc1ccc(C(=O)NC2C3CC4CC(C3)CC2C4)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
EPHX2 P34913 8/20 0.52
HSD11B1 P28845 2/20 0.50
HDAC1 Q13547 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44

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
SCHEMBL3809081 0.82 EPHX2 (0.51) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL3809079 0.82 HSD11B1 (0.51) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL241938 0.81 L3MBTL1 (0.58) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL3809076 0.80 L3MBTL1 (0.49) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL238713 0.80 L3MBTL1 (0.57) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL1675682 0.79 KMT2A (0.74) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL19808151 0.76 HSD11B1 (0.54) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL3809265 0.76 L3MBTL1 (0.45) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL3809268 0.76 CYP3A4 (0.49) KMT2AMEN1L3MBTL1EPHX2HSD11B1
SCHEMBL2536584 0.76 RAB9A (0.57) KMT2AMEN1

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-1948190-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2008-07-30 EP disclosed
WO-2007051810-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2007-05-10 WO disclosed