SCHEMBL10325546

SCHEMBL10325546

C=CCOC=C(O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.36
TSHR P16473 2/20 0.34
MAPT P10636 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL11385818 0.81 CYP3A4 (0.32) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL1234336 0.77 TSHR (0.32) CYP3A4TSHRALDH1A1TDP1
SCHEMBL9501577 0.77 TSHR (0.32) CYP3A4TSHRALDH1A1TDP1
SCHEMBL28020992 0.77 CYP3A4 (0.32) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL6557726 0.76
Bicarbonate SCHEMBL4344138 0.72 CYP3A4 (0.35) CYP3A4TSHRMAPTCACNA1BAPBA1
Bicarbonate SCHEMBL28747310 0.71 CYP3A4 (0.38) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL5008766 0.70 CAMK2A (0.35) TSHR
SCHEMBL11668641 0.70
SCHEMBL669729 0.70

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
CN-114335895-A Functional layer material for coating lithium ion battery diaphragm 浙江杰特维新材料有限公司 2022-04-12 CN disclosed
US-9879153-B2 Anti-icing composite WANG LIANG (US) 2018-01-30 US disclosed
US-20160009971-A1 Anti-Icing Composite WANG LIANG (US) 2016-01-14 US disclosed
US-20120184653-A1 Synthesis of linear phosphorus-containing functional fluorocopolymer WANG LIANG (US) 2012-07-19 US disclosed