SCHEMBL3663151

SCHEMBL3663151

CCOCC(OCC)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.40
KCNN4 O15554 2/20 0.36
LMNA P02545 2/20 0.35
KIF11 P52732 2/20 0.34
TAAR1 Q96RJ0 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
ACSS2 Q9NR19 1/20 0.32
TK2 O00142 1/20 0.32
TACR1 P25103 1/20 0.32
LTA4H P09960 1/20 0.31
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31

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
SCHEMBL9194628 0.81 KCNN4 (0.40) MAPK1KCNN4LMNAKIF11TAAR1
SCHEMBL28893285 0.80 MAPK1 (0.40) MAPK1KCNN4LMNAKIF11TAAR1
SCHEMBL14127315 0.78 KCNN4 (0.38) MAPK1KCNN4LMNAKIF11TAAR1
SCHEMBL662477 0.78 TAAR1 (0.48) MAPK1KCNN4LMNAKIF11TAAR1
SCHEMBL663136 0.78 ALDH1A1 (0.39) MAPK1KCNN4LMNAKIF11TAAR1
SCHEMBL14269138 0.77 MAPK1 (0.44) MAPK1KCNN4KIF11TAAR1ALDH1A1
SCHEMBL4475522 0.76 MAPK1 (0.36) MAPK1KCNN4LMNAKIF11TAAR1
SCHEMBL11497301 0.75 MAPK1 (0.48) MAPK1KCNN4TAAR1ALDH1A1ALOX15
SCHEMBL15357624 0.74 LMNA (0.44) MAPK1KCNN4LMNAKIF11TAAR1
SCHEMBL11786495 0.74 KIF11 (0.46) KCNN4KIF11TAAR1CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2351730-B1 ETHOXY DIPHENYL ETHANE DERIVATES, PREPARATION PROCESSES AND USES THEREOF SHANGHAI ECUST BIOMEDICINE CO LTD (CN) 2014-07-30 EP claimed
WO-2010043180-A1 ETHOXY DIPHENYL ETHANE DERIVATES, PREPARATION PROCESSES AND USES THEREOF 上海华理生物医药有限公司 (CN) 2010-04-22 WO disclosed