SCHEMBL19880256

SCHEMBL19880256

CCCC(C)C(=S)NCCC#N

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.35
▸ MCL1 Q07820 1/20 0.32
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL10457647 0.79 TSHR (0.33) TSHRMAPT
SCHEMBL11677024 0.68 — —
SCHEMBL10462502 0.68 — —
SCHEMBL21886619 0.67 CA1 (0.47) TSHR
SCHEMBL19287551 0.67 ALDH1A1 (0.52) TSHR
SCHEMBL10033567 0.67 TSHR (0.42) TSHRMCL1MAPT
SCHEMBL3361100 0.65 — —
SCHEMBL10458963 0.65 — —
SCHEMBL31616924 0.64 TSHR (0.39) TSHR
SCHEMBL14672993 0.64 CTSS (0.50) TSHRLMNAMAPTMAPK1

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-9896472-B2 Protected monomer and method of final deprotection for RNA synthesis AGILENT TECHNOLOGIES, INC. (US) 2018-02-20 — — US disclosed
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