SCHEMBL2728633

SCHEMBL2728633

Cc1ccc(C)c(Sc2cc(C)ccc2C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.58
MAPT P10636 2/20 0.58
TP53 P04637 2/20 0.58
ALOX15 P16050 2/20 0.58
LMNA P02545 2/20 0.58
GAA P10253 2/20 0.58
HPGD P15428 2/20 0.58
MEN1 O00255 1/20 0.58
ALOX12 P18054 1/20 0.58
KMT2A Q03164 1/20 0.58
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 3/20 0.46
JAK2 O60674 1/20 0.45
HSP90AA1 P07900 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2A6 P11509 2/20 0.41
HTR1A P08908 3/20 0.41
HTR3A P46098 3/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL29823896 1.00 HSD17B10 (0.58) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL13386228 0.91 HSD17B10 (0.50) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL9487702 0.89 MAPT (0.48) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL12703284 0.87 ALDH1A1 (0.48) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL9488729 0.87 MAPT (0.47) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL11601099 0.85 MAPT (0.55) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL9486972 0.84 MAPT (0.46) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL9488946 0.84 HTR1A (0.45) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL916078 0.83 NPC1 (0.50) HSD17B10MAPTTP53ALOX15LMNA
SCHEMBL38665977 0.83 NPC1 (0.50) HSD17B10MAPTTP53ALOX15LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2632896-A2 ELECTROPHILIC REAGENTS FOR MONOHALOMETHYLATION,THEIR PREPARATION AND THEIR USES Hovione Inter Limited (CH) 2013-09-04 EP disclosed
WO-2012056201-A2 ELECTROPHILIC REAGENTS FOR MONOHALOMETHYLATION,THEIR PREPARATION AND THEIR USES HOVIONE INTER LIMITED (CH) 2012-05-03 WO disclosed
EP-1565497-B1 OPTICAL MEMBERS AND COMPOSITIONS FOR PRODUCING THEM FUJIFILM CORP (JP) 2009-03-04 EP disclosed
US-7343073-B2 Optical members and compositions for producing them FUJIFILM CORPORATION (JP) 2008-03-11 US disclosed
US-7343073-B2 Optical members and compositions for producing them FUJIFILM CORPORATION (JP) 2008-03-11 US disclosed
WO-2002016570-A1 DMS:ACCEPTOR OXIDOREDUCTASE THE UNIVERSITY OF QUEENSLAND (AU) 2002-02-28 WO disclosed
US-5250657-A Process for preparing polyarylene thioether SEISAN KAIHATSU KAGAKU KENKYUSHO (JP) 1993-10-05 US disclosed
EP-0440106-A2 Process for preparing polyarylene thioethers SEISAN KAIHATSU KAGAKU KENKYUSHO (JP) 1991-08-07 EP disclosed