SCHEMBL31443214

SCHEMBL31443214

C=CCOC(=O)C(C)CCCCCC.CCCCCCC(C)C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
ZDHHC7 Q9NXF8 1/20 0.49
ABCB1 P08183 1/20 0.46
CA1 P00915 3/20 0.42
CA2 P00918 1/20 0.40
ACE2 Q9BYF1 1/20 0.39
LMNA P02545 3/20 0.39
USP2 O75604 1/20 0.39
BIRC2 Q13490 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PLA2G2C Q5R387 1/20 0.37
FAAH O00519 2/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
ADH1B P00325 1/20 0.37
ADH1C P00326 1/20 0.37
ADH1A P07327 1/20 0.37
ADH4 P08319 1/20 0.37

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
SCHEMBL31443216 0.94 TSHR (0.46) TSHRZDHHC7ABCB1CA1CA2
SCHEMBL28840191 0.94 TSHR (0.57) TSHRZDHHC7ABCB1CA1ACE2
SCHEMBL7165375 0.94 TSHR (0.57) TSHRZDHHC7ABCB1CA1ACE2
SCHEMBL8650440 0.94 TSHR (0.57) TSHRZDHHC7ABCB1CA1ACE2
SCHEMBL4957257 0.92 TSHR (0.54) TSHRZDHHC7ABCB1CA1ACE2
Methylene Chloride SCHEMBL28116180 0.89 TSHR (0.53) TSHRZDHHC7ABCB1CA1ACE2
SCHEMBL31443210 0.87 TDP1 (0.41) TSHRZDHHC7ABCB1CA1CA2
SCHEMBL12913888 0.87 TSHR (0.51) TSHRCA1CA2ACE2LMNA
SCHEMBL560716 0.85 ZDHHC7 (0.63) ZDHHC7ABCB1CA1CA2ACE2
SCHEMBL2534208 0.85 ZDHHC7 (0.63) ZDHHC7ABCB1CA1CA2ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591771-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2025-03-11 CN claimed