SCHEMBL16447477

SCHEMBL16447477

CCC(N)Oc1cc(OC(N)CC)cc(OC(N)CC)c1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL9325387 0.91 ALDH1A1 (0.48) ALDH1A1
SCHEMBL1735150 0.86 ALDH1A1 (0.38) ALDH1A1
Hydrochloric Acid SCHEMBL9122124 0.84 ALDH1A1 (0.36) ALDH1A1
SCHEMBL9325829 0.84 ALDH1A1 (0.41) ALDH1A1
SCHEMBL10556469 0.80 TAAR1 (0.51) ALDH1A1
SCHEMBL9325840 0.80 ALDH1A1 (0.43) ALDH1A1
SCHEMBL1033247 0.78 SLC6A4 (0.43) ALDH1A1
SCHEMBL9326252 0.78 TP53 (0.55) ALDH1A1
SCHEMBL10548438 0.77 MAOB (0.47) ALDH1A1
SCHEMBL10550130 0.77 ACHE (0.41) 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-3030683-A1 PROTECTED FLUORESCENT REAGENT COMPOUNDS Pacific Biosciences Of California, Inc. (US) 2016-06-15 EP disclosed
WO-2015021079-A1 PROTECTED FLUORESCENT REAGENT COMPOUNDS PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2015-02-12 WO disclosed