SCHEMBL9702141

SCHEMBL9702141

CCN(CC)C(C)OC(C)OC(C)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 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
SCHEMBL749807 0.88 TSHR (0.33) ALDH1A1TSHR
SCHEMBL9705188 0.85 LMNA (0.30)
SCHEMBL28540130 0.78
SCHEMBL529708 0.77 FDPS (0.32)
SCHEMBL7751431 0.74 TSHR (0.55) TSHR
SCHEMBL6694567 0.74 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL232569 0.73 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL6700781 0.71 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL10821574 0.70 TSHR (0.36) TSHR
SCHEMBL9700088 0.70 FDPS (0.37) TSHR

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-5108880-A Developing agent, sulfite preservative and amino alcohol SUN CHEMICAL CORPORATION (US) 1992-04-28 US claimed
US-5108880-A Developing agent, sulfite preservative and amino alcohol SUN CHEMICAL CORPORATION (US) 1992-04-28 US disclosed