SCHEMBL8561226

SCHEMBL8561226

C1CN2CCN1CC2.CCCC[Sn](CCCC)(OC(C)=O)O[Sn](CCCC)(CCCC)OC(C)=O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL555915 0.89 ALDH1A1 (0.41) ALDH1A1
SCHEMBL556316 0.87 ALDH1A1 (0.40) ALDH1A1
Acetic Acid SCHEMBL28104724 0.84 ALDH1A1 (0.38) ALDH1A1
SCHEMBL11744217 0.82 ALDH1A1 (0.36) ALDH1A1
SCHEMBL557512 0.82 ALDH1A1 (0.39) ALDH1A1
SCHEMBL556789 0.82 ALDH1A1 (0.39) ALDH1A1
SCHEMBL133348 0.81 ALDH1A1 (0.44) ALDH1A1
SCHEMBL1082002 0.80 ALDH1A1 (0.38) ALDH1A1
Water SCHEMBL9118662 0.80 ALDH1A1 (0.38) ALDH1A1
SCHEMBL7889813 0.79 ALDH1A1 (0.38) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0830421-A1 MODIFIED AMINO CROSSLINKING AGENTS CYTEC TECHNOLOGY CORP. (US) 1998-03-25 EP disclosed
WO-1996040825-A1 MODIFIED AMINO CROSSLINKING AGENTS CYTEC TECHNOLOGY CORP. (US) 1996-12-19 WO disclosed