SCHEMBL11866497

SCHEMBL11866497

CCCCCC(O)CC[C@H]1C=CC(=O)[C@H]1CCCCC(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 2/20 0.48
▸ NR4A2 P43354 2/20 0.48
▸ PTGER2 P43116 7/20 0.48
▸ PTGER3 P43115 2/20 0.48
▸ PTGER4 P35408 1/20 0.48
▸ DNTT P04053 1/20 0.46
▸ PPARG P37231 4/20 0.44
▸ PPARA Q07869 2/20 0.44
▸ PPARD Q03181 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ DAGLA Q9Y4D2 1/20 0.39
▸ TBXA2R P21731 1/20 0.38
▸ PTGFR P43088 1/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ FFAR1 O14842 1/20 0.38

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
SCHEMBL11866505 1.00 TRPA1 (0.48) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL11867713 0.89 TRPA1 (0.49) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL11867721 0.89 TRPA1 (0.49) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL10704086 0.85 DNTT (0.44) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL11867811 0.85 DNTT (0.42) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL11867800 0.85 DNTT (0.42) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL11866493 0.84 DNTT (0.50) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL11866489 0.84 DNTT (0.50) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL11869689 0.83 TRPA1 (0.42) TRPA1NR4A2PTGER2PTGER3PTGER4
SCHEMBL11869680 0.83 TRPA1 (0.42) TRPA1NR4A2PTGER2PTGER3PTGER4

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-3984455-A Prostaglandin E1 analogs THE UPJOHN COMPANY (US) 1976-10-05 — — US disclosed
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