SCHEMBL16813541

SCHEMBL16813541

CCN(CC)CCCN(CCCN(CC)CC)CCC[Si](C)(OC)OC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL379299 0.96 ALDH1A1 (0.33) ALDH1A1
SCHEMBL16813822 0.92 ALDH1A1 (0.32) ALDH1A1
SCHEMBL16390223 0.91 CHRM2 (0.32) ALDH1A1
SCHEMBL16813175 0.90
SCHEMBL379353 0.89 ALDH1A1 (0.36) ALDH1A1
SCHEMBL2244060 0.89
SCHEMBL16813350 0.88
SCHEMBL329589 0.86 DNM1 (0.31) ALDH1A1
SCHEMBL16813557 0.86
SCHEMBL31687753 0.86 ALDH1A1 (0.31) 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
US-9062182-B2 Terminal modifier for conjugated diene polymers KOREA KUMBO PETROCHEMICAL CO., LTD. (KR) 2015-06-23 US claimed
US-9062182-B2 Terminal modifier for conjugated diene polymers KOREA KUMBO PETROCHEMICAL CO., LTD. (KR) 2015-06-23 US disclosed