SCHEMBL11084288

SCHEMBL11084288

O=C1C[C@@H]2CC(OC3CCCCO3)C(CO)[C@@H]2C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL11093136 0.85 ABCB1 (0.33) ABCB1
SCHEMBL10729080 0.81 MEN1 (0.40) MEN1KMT2A
SCHEMBL21509142 0.80 ABCB1 (0.30) ABCB1
SCHEMBL21509155 0.80 ABCB1 (0.30) ABCB1
SCHEMBL21495216 0.80 ABCB1 (0.30) ABCB1
SCHEMBL30267565 0.80 ABCB1 (0.30) ABCB1
SCHEMBL20954693 0.80 RAB9A (0.46) ABCB1
SCHEMBL15445614 0.80 RAB9A (0.46) ABCB1
SCHEMBL4607150 0.80 RAB9A (0.46) ABCB1
SCHEMBL3710880 0.80 RAB9A (0.46) ABCB1

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-4479966-A 6,9-Methano-PGI2 analogues ONO PHARMACEUTICAL COMPANY, LTD. (JP) 1984-10-30 US disclosed