SCHEMBL11614770

SCHEMBL11614770

CCCCCCC=C(I)OC1CCCOC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.39
EP300 Q09472 1/20 0.31
PDE4D Q08499 2/20 0.30
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30

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
SCHEMBL11615227 1.00 NAAA (0.39) NAAAEP300PDE4DPDE4APDE4B
SCHEMBL11614339 0.83 NAAA (0.35) NAAA
SCHEMBL14715861 0.74 NAAA (0.34) NAAAEP300
SCHEMBL10486020 0.74 NAAA (0.34) NAAAEP300
SCHEMBL18974981 0.73 NAAA (0.69) NAAA
SCHEMBL9806439 0.71 NAAA (0.61) NAAAPDE4DPDE4APDE4BPDE4C
SCHEMBL458567 0.70 ALDH1A1 (0.43) NAAA
SCHEMBL28862976 0.69 ALDH1A1 (0.42) NAAAPDE4DPDE4APDE4BPDE4C
SCHEMBL11497336 0.69 EP300 (0.45) EP300
SCHEMBL11497335 0.69 EP300 (0.45) EP300

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-4117014-A PROSTAGLANDIN DERIVATIVES ABBOTT LABORATORIES (US) 1978-09-26 US disclosed