SCHEMBL28508269

SCHEMBL28508269

CCC(N)[N+](C)(C)C(C)O

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
ALDH1A1 P00352 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
Hydrochloric Acid SCHEMBL27605145 0.97 TSHR (0.36) TSHRALDH1A1
SCHEMBL28376772 0.79 TSHR (0.32) TSHR
Hydrochloric Acid SCHEMBL29086616 0.77 TSHR (0.30) TSHR
SCHEMBL6691192 0.72 TSHR (0.42) TSHR
SCHEMBL23392536 0.72 TP53 (0.33)
SCHEMBL27427767 0.70 TSHR (0.41) TSHR
SCHEMBL232452 0.69
SCHEMBL908843 0.67
Bromide SCHEMBL3006377 0.66 ALDH1A1 (0.39) ALDH1A1
Water SCHEMBL2778703 0.66 ALDH1A1 (0.39) ALDH1A1

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-112226225-A Temperature-resistant and salt-resistant surfactant composition for pressure reduction and injection increase of water injection well of low-permeability oil reservoir and preparation method and application thereof 中国石油化工股份有限公司 2021-01-15 CN disclosed