SCHEMBL9876223

SCHEMBL9876223

CC1(C)Oc2ccc(C#N)cc2[C@H](NC2COC(=O)C2)[C@H]1O

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 8/20 0.58
ABCB1 P08183 11/20 0.55

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
SCHEMBL9443651 0.80 ABCC9 (0.41) ABCC9ABCB1
SCHEMBL9876547 0.77 ABCC9 (0.51) ABCC9ABCB1
SCHEMBL9197746 0.77 ABCC9 (0.68) ABCC9ABCB1
SCHEMBL9197751 0.77 ABCC9 (0.68) ABCC9ABCB1
SCHEMBL9197759 0.77 ABCC9 (0.68) ABCC9ABCB1
SCHEMBL9876501 0.77 ABCC9 (0.59) ABCC9ABCB1
SCHEMBL9876500 0.77 ABCC9 (0.59) ABCC9ABCB1
SCHEMBL9876499 0.77 ABCC9 (0.59) ABCC9ABCB1
SCHEMBL9875768 0.76 KDM4E (0.58) ABCC9ABCB1
SCHEMBL9273375 0.76 ABCC9 (0.78) ABCC9ABCB1

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-5071871-A Pharmaceutically useful benzo(β)pyranes and pyranopyridines SANDOZ LTD. (CH) 1991-12-10 US disclosed