SCHEMBL21283160

SCHEMBL21283160

CC(C)[C@H](C)CNCCO

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7953333 1.00 TSHR (0.32) TSHRSMN1; SMN2
SCHEMBL31008668 0.83
SCHEMBL4650572 0.82 TSHR (0.34) TSHRSMN1; SMN2
SCHEMBL9407525 0.78 TSHR (0.33) TSHRSMN1; SMN2
SCHEMBL7967492 0.78
SCHEMBL605994 0.78
SCHEMBL9051445 0.77 MEN1 (0.31) TSHRSMN1; SMN2
SCHEMBL4474067 0.77 MEN1 (0.31) TSHRSMN1; SMN2
SCHEMBL277768 0.76 ADH1B (0.32)
SCHEMBL1425004 0.76

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
WO-2019161224-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS GiraFpharma LLC (US) 2019-08-22 WO disclosed