SCHEMBL14565366

SCHEMBL14565366

CCN1CCC(OP=O)CC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
HRH3 Q9Y5N1 3/20 0.40
CHRM3 P20309 1/20 0.38
KDM4E B2RXH2 2/20 0.35
HSD11B1 P28845 1/20 0.34
EPHX1 P07099 1/20 0.34
EPHX2 P34913 1/20 0.34
RECQL P46063 1/20 0.33
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL70520 0.73 HRH3 (0.44) SMN1; SMN2HRH3CHRM3KDM4EHSD11B1
SCHEMBL10241703 0.72 SMN1; SMN2 (0.44) SMN1; SMN2HRH3CHRM3KDM4EHSD11B1
SCHEMBL7903518 0.71 HRH3 (0.43) SMN1; SMN2HRH3CHRM3HSD11B1
SCHEMBL18773643 0.71 SMN1; SMN2 (0.47) SMN1; SMN2HRH3CHRM3KDM4EHSD11B1
SCHEMBL27880313 0.71 HRH3 (0.43) SMN1; SMN2HRH3CHRM3HSD11B1
SCHEMBL15387018 0.71 HRH3 (0.43) SMN1; SMN2HRH3CHRM3KDM4EHSD11B1
SCHEMBL15684438 0.71
SCHEMBL28784801 0.71 SMN1; SMN2 (0.42) SMN1; SMN2HRH3CHRM3KDM4EHSD11B1
SCHEMBL13520344 0.69 SMN1; SMN2 (0.41) SMN1; SMN2HRH3CHRM3KDM4EHSD11B1
SCHEMBL4695552 0.69 SMN1; SMN2 (0.50) SMN1; SMN2HRH3CHRM3HSD11B1RECQL

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
WO-2007025009-A2 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2007-03-01 WO disclosed