SCHEMBL21024993

SCHEMBL21024993

COc1cc(-c2cc3ncccc3c(O[C@H](C)[C@H]3CCCC(=O)C3)n2)ccc1OC(F)(F)F

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 20/20 0.78
FLT3 P36888 1/20 0.78
AURKB Q96GD4 1/20 0.78

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
SCHEMBL21024989 0.92 SYK (0.76) SYKFLT3AURKB
SCHEMBL21024994 0.87 SYK (1.00) SYKFLT3AURKB
SCHEMBL10196056 0.87 SYK (1.00) SYKFLT3AURKB
SCHEMBL21025481 0.85 SYK (0.75) SYKFLT3AURKB
SCHEMBL21025245 0.83 SYK (0.78) SYK
SCHEMBL10196471 0.79 SYK (1.00) SYKFLT3AURKB
SCHEMBL12435330 0.79 SYK (1.00) SYKFLT3AURKB
SCHEMBL10196488 0.79 SYK (1.00) SYKFLT3AURKB
SCHEMBL10196476 0.79 SYK (1.00) SYKFLT3AURKB
SCHEMBL523114 0.78 SYK (1.00) SYKFLT3AURKB

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
EP-3119772-B1 HETEROARYL SIK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2019-05-22 EP disclosed