SCHEMBL2202219

SCHEMBL2202219

CC1CCC(N2Cc3ccc(-c4ccc(N)cc4)cc3C2=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 5/20 0.44
TDP2 O95551 1/20 0.38
GRM5 P41594 1/20 0.37
GRM1 Q13255 1/20 0.37
NPY1R P25929 1/20 0.36
NPY5R Q15761 1/20 0.36
TNF P01375 2/20 0.36
MAP3K5 Q99683 2/20 0.35
RORC P51449 1/20 0.35
MAOA P21397 2/20 0.35
MAPK1 P28482 1/20 0.34
BMPR1A P36894 1/20 0.34
ACVRL1 P37023 1/20 0.34
ACVR1 Q04771 1/20 0.34
PKM P14618 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
SCHEMBL2202216 1.00 CRBN (0.44) CRBNTDP2GRM5GRM1NPY1R
SCHEMBL13719272 0.83 CRBN (0.39) CRBNNPY1RNPY5RMAP3K5MAOA
SCHEMBL13719274 0.80 CRBN (0.42) CRBNTDP2NPY1RNPY5RMAP3K5
SCHEMBL16850272 0.79 CRBN (0.54) CRBNGRM5GRM1RORCMAOA
SCHEMBL25894733 0.76 CRBN (0.54) CRBNNPY1RNPY5R
SCHEMBL7238057 0.75 CRBN (0.56) CRBNNPY1RNPY5RMAOA
SCHEMBL31252792 0.75 CRBN (0.56) CRBNNPY1RNPY5RMAOA
SCHEMBL13829131 0.75 TDP2 (0.45) CRBNTDP2MAPK1
SCHEMBL2202780 0.75 CRBN (0.37) CRBNNPY1RNPY5RMAP3K5
SCHEMBL25673270 0.74 CRBN (0.50) CRBNNPY1RNPY5R

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-2519500-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Healthcare Ltd. (IN) 2012-11-07 EP disclosed
WO-2011080718-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-07-07 WO disclosed