SCHEMBL6567234

SCHEMBL6567234

NC(=O)c1cccc(OCCCC(NCc2ccc(C(=O)O)cc2)C(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 1/20 0.47
PARP10 Q53GL7 2/20 0.43
SRD5A2 P31213 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
KMT2A Q03164 1/20 0.40
NR4A2 P43354 1/20 0.40
F2 P00734 1/20 0.40
PLG P00747 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
C1S P09871 1/20 0.40
PRSS3 P35030 1/20 0.40
CHRM2 P08172 1/20 0.39
TNKS O95271 1/20 0.39
PARP15 Q460N3 1/20 0.39
PARP14 Q460N5 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
PARP2 Q9UGN5 1/20 0.39
F10 P00742 1/20 0.39
KDM1A O60341 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
SCHEMBL6566864 0.92 NR1H3 (0.49) NR1H3PARP10SMN1; SMN2KMT2AF2
SCHEMBL6513456 0.74 NR1H3 (0.76) NR1H3SRD5A2KMT2A
SCHEMBL7451063 0.72 NR4A2 (0.70) PARP10SRD5A2SMN1; SMN2KMT2ANR4A2
SCHEMBL6566919 0.72 NR1H3 (0.44) NR1H3SMN1; SMN2F10
SCHEMBL203431 0.72 PRSS1 (0.67) PARP10KMT2ANR4A2F2PLG
SCHEMBL3979585 0.70 PRSS1 (0.65) PARP10KMT2ANR4A2F2PLG
SCHEMBL201415 0.70 PARP1 (0.55) NR1H3PARP10KMT2AF2PLG
SCHEMBL204344 0.69 NR4A2 (0.56) PARP10KMT2ANR4A2F2PLG
SCHEMBL7451728 0.68 SIRT2 (0.60) PARP10KMT2ANR4A2F2PLG
SCHEMBL6511060 0.68 NR1H3 (0.76) NR1H3KMT2ANR4A2

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
EP-1318976-B1 SUBSTITUTED AMINOPROPOXYARYL DERIVATIVES USEFUL AS AGONISTS FOR LXR GLAXO GROUP LTD (GB) 2004-11-24 EP disclosed