SCHEMBL9734705

SCHEMBL9734705

CCCCCCCCCCCCC(O)C1=C(Br)C(=O)OC1OC

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 1/20 0.37
ZDHHC7 Q9NXF8 1/20 0.36
TOP1 P11387 2/20 0.34
NAAA Q02083 1/20 0.34
PDCD4 Q53EL6 3/20 0.33
HSPD1 P10809 1/20 0.33
HSPE1 P61604 1/20 0.33
TST Q16762 1/20 0.33
MAPT P10636 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PTPN1 P18031 1/20 0.33
PPARG P37231 1/20 0.33

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
SCHEMBL9734932 0.82 PDCD4 (0.41) DAGLAPDCD4PPARG
SCHEMBL9735225 0.70 TOP1 (0.40) DAGLATOP1PDCD4
SCHEMBL8616760 0.63 PDCD4 (0.42) DAGLAPDCD4
SCHEMBL4100839 0.62 HIF1A (0.50)
SCHEMBL7290380 0.59 GPR84 (0.56) ZDHHC7MAPT
SCHEMBL28631358 0.59 GPR84 (0.56) ZDHHC7MAPT
SCHEMBL6434519 0.59 GPR84 (0.56) ZDHHC7MAPT
SCHEMBL3175045 0.59
SCHEMBL6651887 0.59 GPR84 (0.56) ZDHHC7MAPT
SCHEMBL8363305 0.59 GPR84 (0.56) ZDHHC7MAPT

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