SCHEMBL9901000

SCHEMBL9901000

C=C(C)COc1ccccc1OCI

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.42
POLB P06746 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GLA P06280 1/20 0.42
GPR174 Q9BXC1 1/20 0.41
HSD17B10 Q99714 4/20 0.38
ALDH1A1 P00352 7/20 0.37
LMNA P02545 5/20 0.37
NPSR1 Q6W5P4 5/20 0.37
KDM4E B2RXH2 3/20 0.37
TSHR P16473 2/20 0.37
KMT2A Q03164 6/20 0.36
MAPT P10636 6/20 0.36
MEN1 O00255 5/20 0.36
TP53 P04637 3/20 0.36
HTT P42858 3/20 0.36
HPGD P15428 2/20 0.36
USP2 O75604 2/20 0.36
ALOX12 P18054 2/20 0.36
GAA P10253 2/20 0.35

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
SCHEMBL29457182 0.90 SMN1; SMN2 (0.48) SMN1; SMN2POLBL3MBTL1GLAGPR174
SCHEMBL9750660 0.90 SMN1; SMN2 (0.48) SMN1; SMN2POLBL3MBTL1GLAGPR174
SCHEMBL5785927 0.82 SMN1; SMN2 (0.61) SMN1; SMN2POLBL3MBTL1HSD17B10LMNA
SCHEMBL5784873 0.82 L3MBTL1 (0.61) SMN1; SMN2POLBL3MBTL1GLAGPR174
SCHEMBL10158674 0.81 GPR174 (0.41) SMN1; SMN2POLBL3MBTL1GLAGPR174
SCHEMBL10870502 0.80 MEN1 (0.45) SMN1; SMN2POLBL3MBTL1GLAGPR174
SCHEMBL14690371 0.79 MBTPS1 (0.48) SMN1; SMN2POLBL3MBTL1GLAGPR174
SCHEMBL8390273 0.78 GAA (0.55) SMN1; SMN2L3MBTL1GPR174HSD17B10ALDH1A1
SCHEMBL5786743 0.78 NOTUM (0.51) SMN1; SMN2POLBGLAALDH1A1LMNA
SCHEMBL28012013 0.78 MAPT (0.55) SMN1; SMN2L3MBTL1MAPTHTTMAPK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2788339-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS Autifony Therapeutics Limited (GB) 2014-10-15 EP disclosed
EP-2649066-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS Autifony Therapeutics Limited (GB) 2013-10-16 EP disclosed
WO-2013083994-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS AUTIFONY THERAPEUTICS LIMITED (GB) 2013-06-13 WO disclosed
WO-2012076877-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS AUTIFONY THERAPEUTICS LIMITED (GB) 2012-06-14 WO disclosed