SCHEMBL14098081

SCHEMBL14098081

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.46
▸ TRPA1 O75762 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NR4A1 P22736 1/20 0.46
▸ PTPN7 P35236 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ PTGER4 P35408 3/20 0.45
▸ PTGER3 P43115 2/20 0.45
▸ PTGER2 P43116 1/20 0.45
▸ MAPT P10636 2/20 0.43
▸ UCHL3 P15374 1/20 0.43
▸ FAAH O00519 4/20 0.40
▸ PLA2G4B P0C869 1/20 0.40
▸ PLA2G4A P47712 1/20 0.40
▸ BLM P54132 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
SCHEMBL14138463 0.98 TRPA1 (0.43) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL10020993 0.86 PTGER4 (0.42) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL2738721 0.86 PTGER4 (0.42) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL3439785 0.86 PTGER4 (0.42) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL10052576 0.85 PTGER4 (0.40) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL10052678 0.85 PTGER4 (0.40) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL2948238 0.82 PTGER4 (0.48) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL2948236 0.82 PTGER4 (0.48) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL2738718 0.82 TRPA1 (0.46) ALDH1A1TRPA1MEN1LMNAPOLB
SCHEMBL10020985 0.82 TRPA1 (0.46) ALDH1A1TRPA1MEN1LMNAPOLB

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
US-7417067-B2 Composition and method for stabilizing the same SUCAMPO AG (CH) 2008-08-26 — — US disclosed
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