SCHEMBL14337402

SCHEMBL14337402

CCCCC(CC)C(=O)OCC(C)(C)C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.63
CA1 P00915 4/20 0.63
MAPK1 P28482 2/20 0.53
ATM Q13315 2/20 0.44
GAA P10253 1/20 0.44
XBP1 P17861 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 3/20 0.40
CYP3A4 P08684 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CTSK P43235 1/20 0.39
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
USP2 O75604 1/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 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
Ethylene Glycol SCHEMBL247217 0.95 CA2 (0.58) CA2CA1MAPK1ATMGAA
SCHEMBL28829107 0.93 CA2 (0.55) CA2CA1MAPK1ATMGAA
SCHEMBL9960580 0.89 CA2 (0.63) CA2CA1MAPK1ATMGAA
SCHEMBL296220 0.89 CA2 (0.63) CA2CA1MAPK1ATMGAA
SCHEMBL93763 0.89 CA2 (0.63) CA2CA1MAPK1ATMGAA
SCHEMBL14640944 0.89 CA2 (0.63) CA2CA1MAPK1ATMGAA
SCHEMBL15442941 0.87 CA2 (0.61) CA2CA1MAPK1ATMGAA
SCHEMBL20253309 0.86 CA2 (0.42) CA2CA1MAPK1TSHRSLC1A3
SCHEMBL31396735 0.85 CA2 (0.59) CA2CA1MAPK1ATMGAA
SCHEMBL29274090 0.85 CA2 (0.59) CA2CA1MAPK1ATMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112716816-B Cosmetic product and cosmetic method 迈图高新材料(南通)有限公司 2022-08-23 CN disclosed
CN-114515257-A Silicone emulsions and personal care products containing the same 莫门蒂夫性能材料股份有限公司 2022-05-20 CN disclosed
CN-112716816-A Cosmetic product and cosmetic method 迈图高新材料(南通)有限公司 2021-04-30 CN disclosed
US-7312266-B2 Organic thiol metal-free stabilizers and plasticizers for halogen-containing polymers THE COLLEGE OF WILLIAM AND MARY (US) 2007-12-25 US disclosed
CN-1149968-C Oil-in-water type emulsified compsns. ������������ʽ���� 2004-05-19 CN disclosed