SCHEMBL28509481

SCHEMBL28509481

CC1(C)OB(c2cnn(C3COCCO3)c2)OC1(C)C

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.42
MAPK1 P28482 1/20 0.31

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
SCHEMBL29234864 0.89 FFAR1 (0.48) FFAR1
SCHEMBL23699731 0.86 FFAR1 (0.46) FFAR1MAPK1
SCHEMBL760525 0.82 FFAR1 (0.42) FFAR1
SCHEMBL31488070 0.82 FFAR1 (0.42) FFAR1
SCHEMBL18010602 0.80 FFAR1 (0.43) FFAR1MAPK1
SCHEMBL1954029 0.80 FFAR1 (0.43) FFAR1MAPK1
SCHEMBL17102316 0.80 FFAR1 (0.43) FFAR1MAPK1
SCHEMBL2567994 0.79 FFAR1 (0.47) FFAR1MAPK1
SCHEMBL28412943 0.78 FFAR1 (0.41) FFAR1MAPK1
SCHEMBL15359061 0.77 FFAR1 (0.49) FFAR1

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
CN-112243439-A Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof 百济神州有限公司 2021-01-19 CN disclosed