SCHEMBL11124971

SCHEMBL11124971

CCCCSP(=O)(OCC)OC1=C(c2ccccc2C)C(=O)CC(C)(C)C1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NPSR1 Q6W5P4 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
SCHEMBL11125168 0.94 SMN1; SMN2 (0.34) SMN1; SMN2KDM4EALDH1A1
SCHEMBL11126795 0.89 BRD4 (0.30) —
SCHEMBL11127501 0.85 — —
SCHEMBL11125223 0.84 SMN1; SMN2 (0.34) SMN1; SMN2ALDH1A1
SCHEMBL11127830 0.83 MEN1 (0.38) SMN1; SMN2ALDH1A1
SCHEMBL11127761 0.83 SMN1; SMN2 (0.35) SMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL11127497 0.82 BRD4 (0.31) —
SCHEMBL11125155 0.82 SMN1; SMN2 (0.38) SMN1; SMN2KDM4EALDH1A1POLBMAPT
SCHEMBL11123726 0.82 LMNA (0.35) NPSR1
SCHEMBL11125226 0.82 SMN1; SMN2 (0.34) SMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4409153-A MITICIDES, OVICIDES, HERBICIDES UNION CARBIDE CORPORATION (US) 1983-10-11 — — US claimed
US-4409153-A MITICIDES, OVICIDES, HERBICIDES UNION CARBIDE CORPORATION (US) 1983-10-11 — — US disclosed
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