SCHEMBL9734932

SCHEMBL9734932

CCCCCCCCCCCCC(O)C1=C(Br)C(=O)OC1O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDCD4 Q53EL6 6/20 0.41
DAGLA Q9Y4D2 1/20 0.40
PPARG P37231 2/20 0.36
GPR84 Q9NQS5 3/20 0.36
FFAR1 O14842 1/20 0.36
POLB P06746 1/20 0.35

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
SCHEMBL9734705 0.82 DAGLA (0.37) PDCD4DAGLAPPARG
SCHEMBL8985042 0.74 PPARG (0.38) PPARGPOLB
SCHEMBL8616760 0.70 PDCD4 (0.42) PDCD4DAGLA
SCHEMBL7296014 0.69 PDCD4 (0.47) PDCD4DAGLA
SCHEMBL21434328 0.66 HIF1A (0.50)
SCHEMBL18196027 0.66 HIF1A (0.50)
SCHEMBL7290380 0.62 GPR84 (0.56) GPR84FFAR1
SCHEMBL6651887 0.62 GPR84 (0.56) GPR84FFAR1
SCHEMBL3175045 0.62
SCHEMBL6434519 0.62 GPR84 (0.56) GPR84FFAR1

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-5134128-A Immunosuppressive and antiproliferative activity for psoriasis and calcium homeostasis ALLERGAN, INC. (US) 1992-07-28 US disclosed
EP-0295056-A1 Anti-inflammatory furanones ALLERGAN, INC (US) 1988-12-14 EP disclosed