SCHEMBL8822983

SCHEMBL8822983

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 3/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ HPGD P15428 3/20 0.50
▸ LMNA P02545 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ NR4A1 P22736 1/20 0.50
▸ PTPN7 P35236 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ MAPT P10636 5/20 0.47
▸ UCHL3 P15374 1/20 0.47
▸ PPARG P37231 5/20 0.43
▸ RECQL P46063 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ MIF P14174 1/20 0.43
▸ GALR3 O60755 1/20 0.43
▸ EP300 Q09472 1/20 0.41
▸ HTT P42858 1/20 0.40

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
SCHEMBL8822989 1.00 TRPA1 (0.50) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL2948516 0.86 TRPA1 (0.61) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL2948519 0.86 TRPA1 (0.61) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL9119832 0.83 TRPA1 (0.55) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL9119838 0.83 TRPA1 (0.55) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL2738721 0.81 PTGER4 (0.42) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL10020993 0.81 PTGER4 (0.42) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL3439785 0.81 PTGER4 (0.42) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL19732190 0.79 TRPA1 (0.64) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL30209147 0.79 TRPA1 (0.59) TRPA1MEN1ALDH1A1KMT2AHPGD

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
EP-0454429-B1 Use of 15-dehydroxy-16-oxoprostaglandin derivatives in the treatment of allergic diseases R TECH UENO LTD (JP) 1997-01-29 — — EP disclosed
EP-0444844-B1 New 15-dehydroxy-16-oxoprostaglandins R TECH UENO LTD (JP) 1995-01-18 — — EP disclosed
US-5221799-A New 15-dehydroxy-16-oxoprostaglandins K.K. UENO SEIYAKU OYO KENKYUJO (JP) 1993-06-22 — — US disclosed
EP-0454429-A2 Use of 15-dehydroxy-16-oxoprostaglandin derivatives in the treatment of allergic diseases Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1991-10-30 — — EP disclosed
EP-0444844-A2 New 15-dehydroxy-16-oxoprostaglandins R-TECH UENO LTD. (JP) 1991-09-04 — — EP disclosed
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