SCHEMBL21022334

SCHEMBL21022334

CCCC(=O)/C=C(\C)c1ccc(CC(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A1 P22736 1/20 0.42
▸ NR4A2 P43354 1/20 0.42
▸ NR4A3 Q92570 1/20 0.42
▸ THRB P10828 5/20 0.36
▸ THRA P10827 4/20 0.36
▸ TBXAS1 P24557 2/20 0.35
▸ HSD17B3 P37058 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ NR1H4 Q96RI1 1/20 0.33
▸ LTB4R Q15722 1/20 0.33
▸ LTB4R2 Q9NPC1 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ MAOB P27338 1/20 0.31
▸ MLYCD O95822 1/20 0.31
▸ IAPP P10997 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
SCHEMBL21020735 0.74 THRA (0.34) NR4A1NR4A2NR4A3THRBTHRA
SCHEMBL18103219 0.73 KMT2A (0.59) THRBTHRAEPHX2NR1H4LMNA
SCHEMBL18290661 0.71 MAPT (0.48) THRBTHRAEPHX2NR1H4LMNA
SCHEMBL15559816 0.70 ALDH1A1 (0.41) THRBTHRAEPHX2NR1H4LMNA
SCHEMBL22868058 0.69 SRD5A2 (0.50) THRBTHRAEPHX2NR1H4LMNA
SCHEMBL26496043 0.69 THRB (0.33) THRBTHRAHSD17B3FAAHEPHX2
SCHEMBL1505324 0.68 ALDH1A1 (0.59) NR4A1NR4A2THRBPOLBL3MBTL1
SCHEMBL13267851 0.68 THRA (0.55) THRBTHRAKMT2AALDH1A1
SCHEMBL13267787 0.67 THRA (0.56) THRBTHRAKMT2AALDH1A1
SCHEMBL13071971 0.67 ESR1 (0.34) THRBTHRAEPHX2NR1H4LMNA

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
EP-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 — — EP disclosed
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