SCHEMBL10632587

SCHEMBL10632587

CCOCCCC(CCOCC)(CCOCC)OCC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL28425083 0.89 ALDH1A1 (0.32) ALDH1A1
SCHEMBL28421644 0.84 ALDH1A1 (0.35) ALDH1A1
SCHEMBL28426320 0.81 ALDH1A1 (0.36) ALDH1A1
SCHEMBL2498506 0.74 ALDH1A1 (0.31) ALDH1A1
Ether SCHEMBL7496783 0.73 SMPD1 (0.38)
SCHEMBL2191404 0.72 TSHR (0.33)
SCHEMBL9316256 0.71 ALDH1A1 (0.32) ALDH1A1
SCHEMBL22977585 0.70 ALDH1A1 (0.39) ALDH1A1
SCHEMBL10290463 0.70 HRH3 (0.43) ALDH1A1
SCHEMBL3308331 0.69 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4785098-A BLUE DYES FOR CELLULOSE HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-15 US disclosed