SCHEMBL7868541

SCHEMBL7868541

CON=C(C)c1ccccc1OC.CON=CCc1ccc(N(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 4/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 2/20 0.35
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.33
TUBB1 Q9H4B7 1/20 0.33
MEN1 O00255 2/20 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
SCHEMBL6816027 0.75 CA1 (0.46) NPSR1L3MBTL1MAPTALDH1A1MAPK1
SCHEMBL7846455 0.70 SLC6A4 (0.41) L3MBTL1NPC1RAB9AMEN1KMT2A
SCHEMBL7866288 0.68 EPHX2 (0.38) L3MBTL1MAPTALDH1A1MAPK1NPC1
SCHEMBL9278957 0.66 MAOB (0.46) MAPTALDH1A1MAPK1NPC1TP53
SCHEMBL7785594 0.66 L3MBTL1 (0.46) L3MBTL1MAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL13703755 0.64 L3MBTL1 (0.45) NPSR1L3MBTL1MAPTALDH1A1MAPK1
SCHEMBL6076750 0.63 KDM4E (0.49) ALDH1A1TP53SMN1; SMN2LMNAKDM4E
SCHEMBL6815139 0.63 CA2 (0.51) MAPTALDH1A1MAPK1NPC1RAB9A
SCHEMBL1444575 0.63 KDM4E (0.49) ALDH1A1TP53SMN1; SMN2LMNAKDM4E
SCHEMBL16587900 0.63 IDO1 (0.43) MAPTALDH1A1MAPK1LMNA

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-1140913-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 EP disclosed
EP-1137645-A2 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034260-A2 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034269-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed