SCHEMBL14577648

SCHEMBL14577648

CCCCCC(=O)/C=C/[C@H]1C=CC(=O)[C@@H]1C/C=C\CCCC(=O)O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 5/20 0.72
▸ HPGD P15428 3/20 0.72
▸ MEN1 O00255 2/20 0.72
▸ ALDH1A1 P00352 2/20 0.72
▸ KMT2A Q03164 2/20 0.72
▸ LMNA P02545 1/20 0.72
▸ POLB P06746 1/20 0.72
▸ NR4A1 P22736 1/20 0.72
▸ PTPN7 P35236 1/20 0.72
▸ SMN1; SMN2 Q16637 1/20 0.72
▸ HIF1A Q16665 1/20 0.72
▸ MAPT P10636 4/20 0.54
▸ UCHL3 P15374 1/20 0.54
▸ NR4A2 P43354 2/20 0.53
▸ ALOX12 P18054 2/20 0.51
▸ PPARG P37231 3/20 0.48
▸ PPARA Q07869 2/20 0.48
▸ MIF P14174 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL11614322 0.88 TRPA1 (0.77) TRPA1HPGDMEN1ALDH1A1KMT2A
SCHEMBL8903380 0.88 TRPA1 (0.77) TRPA1HPGDMEN1ALDH1A1KMT2A
SCHEMBL8903382 0.88 TRPA1 (0.77) TRPA1HPGDMEN1ALDH1A1KMT2A
Prostaglandin A2 SCHEMBL11644837 0.84 ALDH1A1 (1.00) TRPA1HPGDMEN1ALDH1A1KMT2A
Prostaglandin A2 SCHEMBL11879316 0.84 ALDH1A1 (1.00) TRPA1HPGDMEN1ALDH1A1KMT2A
Prostaglandin A2 SCHEMBL11882621 0.84 ALDH1A1 (1.00) TRPA1HPGDMEN1ALDH1A1KMT2A
Prostaglandin A2 SCHEMBL11395152 0.84 ALDH1A1 (1.00) TRPA1HPGDMEN1ALDH1A1KMT2A
Prostaglandin A2 SCHEMBL21670455 0.84 ALDH1A1 (1.00) TRPA1HPGDMEN1ALDH1A1KMT2A
Prostaglandin A2 SCHEMBL8353751 0.84 ALDH1A1 (1.00) TRPA1HPGDMEN1ALDH1A1KMT2A
Prostaglandin A2 SCHEMBL13649325 0.84 ALDH1A1 (1.00) TRPA1HPGDMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7172867-B2 Methods of testing for allergic diseases, and therapeutic agents for treating same GENOX RESEARCH, INC. (JP) 2007-02-06 — — US disclosed
US-7172867-B2 Methods of testing for allergic diseases, and therapeutic agents for treating same GENOX RESEARCH, INC. (JP) 2007-02-06 — — US disclosed
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