SCHEMBL3663149

SCHEMBL3663149

CCOC(Cc1ccccc1)(OCC)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
TP53 P04637 1/20 0.44
SLC6A2 P23975 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
LMNA P02545 1/20 0.39
CYP2D6 P10635 1/20 0.39
RECQL P46063 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MMP8 P22894 1/20 0.38
KIF11 P52732 3/20 0.37
KCNN4 O15554 1/20 0.36
PTPN1 P18031 1/20 0.36
KCNA5 P22460 1/20 0.36
CYP3A4 P08684 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL28074164 0.81 TP53 (0.50) CYP1A2CYP2C9CYP2C19TP53SLC6A2
SCHEMBL5962153 0.81 KCNN4 (0.40) TP53TAAR1LMNACYP2D6ALDH1A1
SCHEMBL1505807 0.79 CYP1A2 (0.48) CYP1A2CYP2C9CYP2C19TP53SLC6A2
SCHEMBL8714252 0.78 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19TP53SLC6A2
SCHEMBL7607884 0.78 TP53 (0.46) CYP1A2CYP2C9CYP2C19TP53SLC6A2
SCHEMBL7606440 0.78 KCNN4 (0.38) CYP1A2CYP2C9CYP2C19TAAR1LMNA
SCHEMBL4058230 0.78 TAAR1 (0.48) TAAR1KIF11KCNN4
SCHEMBL479127 0.78 KCNN4 (0.38) CYP2C19TAAR1LMNACYP2D6ALDH1A1
SCHEMBL3891423 0.78 KCNN4 (0.38) TAAR1LMNACYP2D6ALDH1A1KIF11
SCHEMBL8718960 0.77 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19TP53SLC6A2

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-2351730-B1 ETHOXY DIPHENYL ETHANE DERIVATES, PREPARATION PROCESSES AND USES THEREOF SHANGHAI ECUST BIOMEDICINE CO LTD (CN) 2014-07-30 EP claimed
WO-2020226018-A1 METHOD FOR MANUFACTURING PRINTED MATTER DICグラフィックス株式会社 2020-11-12 WO disclosed
CN-106010311-A Switchable Adhesives 卢敏纳粘合剂公司 2016-10-12 CN disclosed
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