SCHEMBL11386272

SCHEMBL11386272

CC(C)NC1c2c[c]ccc2OC(C)(C)C1O

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 14/20 0.46
▸ ABCC9 O60706 4/20 0.37

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
Hydrochloric Acid SCHEMBL11609075 0.82 ABCB1 (0.59) ABCB1ABCC9
Hydrochloric Acid SCHEMBL11609080 0.82 ABCB1 (0.59) ABCB1ABCC9
Hydrochloric Acid SCHEMBL11397834 0.78 ABCB1 (0.73) ABCB1ABCC9
Hydrochloric Acid SCHEMBL11397832 0.78 ABCB1 (0.73) ABCB1ABCC9
Hydrochloric Acid SCHEMBL11397827 0.78 ABCB1 (0.73) ABCB1ABCC9
SCHEMBL10644307 0.76 ABCB1 (0.75) ABCB1ABCC9
SCHEMBL10644296 0.76 ABCB1 (0.75) ABCB1ABCC9
Hydrochloric Acid SCHEMBL11400062 0.75 ABCB1 (0.52) ABCB1ABCC9
Hydrochloric Acid SCHEMBL11400068 0.75 ABCB1 (0.52) ABCB1ABCC9
Hydrochloric Acid SCHEMBL11400067 0.75 ABCB1 (0.52) ABCB1ABCC9

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-4251537-A Hypotensive 3,4-dihydro-2,2-dimethyl-4-amino-2H-benzo[b]pyran-3-ols BEECHAM GROUP LIMITED (GB) 1981-02-17 — — US claimed
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