SCHEMBL28906289

SCHEMBL28906289

C=CCCCC(C=C)CCC

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
ALDH1A1 P00352 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.32
MMP9 P14780 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
SCHEMBL28906281 0.91 TSHR (0.56) TSHRALDH1A1SMN1; SMN2
SCHEMBL27945572 0.86 TSHR (0.46) TSHRALDH1A1MMP9
SCHEMBL1201129 0.84 TSHR (0.46) TSHRALDH1A1SMN1; SMN2
SCHEMBL3739905 0.83 TSHR (0.46) TSHRALDH1A1SMN1; SMN2
SCHEMBL29047336 0.83 TSHR (0.60) TSHRALDH1A1SMN1; SMN2
SCHEMBL29031770 0.83 TSHR (0.67) TSHRALDH1A1SMN1; SMN2
SCHEMBL1878877 0.83 TSHR (0.46) TSHRALDH1A1SMN1; SMN2
SCHEMBL6278744 0.83 TSHR (0.67) TSHRALDH1A1SMN1; SMN2
SCHEMBL3116337 0.83 TSHR (0.48) TSHRALDH1A1SMN1; SMN2
SCHEMBL4820540 0.83

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-115443283-A Novel metallocene compound, catalyst composition comprising the same, and method for preparing olefin polymer using the same 株式会社LG化学 2022-12-06 CN disclosed