SCHEMBL8910643

SCHEMBL8910643

CCOC(=O)CC1(O)CCCC(/C=C/C(O)CCCCCCCCCCOc2ccccc2)C1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 18/20 0.62
▸ LTB4R2 Q9NPC1 12/20 0.62
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL8910647 1.00 LTB4R (0.62) LTB4RLTB4R2TDP1
SCHEMBL8909589 0.96 LTB4R (0.61) LTB4RLTB4R2TDP1
SCHEMBL8909597 0.96 LTB4R (0.61) LTB4RLTB4R2TDP1
SCHEMBL9049495 0.89 LTB4R (0.74) LTB4RLTB4R2
SCHEMBL9049485 0.89 LTB4R (0.74) LTB4RLTB4R2
SCHEMBL8911394 0.87 LTB4R (0.48) LTB4RLTB4R2TDP1
SCHEMBL8911399 0.87 LTB4R (0.48) LTB4RLTB4R2TDP1
SCHEMBL9051794 0.85 LTB4R (0.74) LTB4RLTB4R2
SCHEMBL9051790 0.85 LTB4R (0.74) LTB4RLTB4R2
SCHEMBL8909288 0.85 LTB4R (0.74) LTB4RLTB4R2

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-5639902-A FOR TREATING PSORIASIS ADIR ET COMPAGNIE (FR) 1997-06-17 — — US disclosed
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