SCHEMBL17367643

SCHEMBL17367643

CCCC[N+](C)=C(N(C)C)N(C)C

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36

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 SCHEMBL4465859 0.82
SCHEMBL8717238 0.79 DNM1 (0.31) ALDH1A1
Hydrochloric Acid SCHEMBL8719778 0.78 EPHX2 (0.30)
SCHEMBL6046915 0.77 ALDH1A1 (0.37) ALDH1A1
SCHEMBL12350081 0.76 CA12 (0.40) ALDH1A1
SCHEMBL8717241 0.73
SCHEMBL5811779 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL13385232 0.73
SCHEMBL4578379 0.70
Hydrochloric Acid SCHEMBL25407559 0.67 CA12 (0.36) 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-20150380168-A1 THIN-LAYER CAPACITORS WITH LARGE SCALE INTEGRATION SIEMENS AKTIENGESELLSCHAFT (DE) 2015-12-31 US disclosed