SCHEMBL28860757

SCHEMBL28860757

NC1([CH]C2(N)CCCCC2)CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL15232145 0.73 TSHR (0.31) TSHRCYP2C19
SCHEMBL1485852 0.73 TSHR (0.36) TSHRCYP2C19
SCHEMBL1485937 0.73
SCHEMBL25294321 0.73 TSHR (0.36) TSHRCYP2C19
SCHEMBL1780853 0.73
SCHEMBL24760446 0.69
SCHEMBL10621331 0.69
SCHEMBL1485708 0.69
SCHEMBL881429 0.69
SCHEMBL23358940 0.65 TSHR (0.38) TSHRCYP2C19

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-108250390-A The aqueous dispersion of a kind of polyurethane or polyurethane-urea, preparation method and purposes 万华化学集团股份有限公司 2018-07-06 CN disclosed