SCHEMBL14286294

SCHEMBL14286294

CC[C@H](C)CCC(C)(C)CC[C@H](O)CC

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 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
SCHEMBL14472608 0.89 TSHR (0.39) TSHR
SCHEMBL18250779 0.82 TSHR (0.35) TSHR
SCHEMBL3665922 0.81 TSHR (0.42) TSHR
SCHEMBL1291170 0.79 TSHR (0.36) TSHR
SCHEMBL20229042 0.79 MEN1 (0.31)
SCHEMBL2378002 0.79
SCHEMBL14220647 0.77 TSHR (0.33) TSHR
SCHEMBL18722151 0.77 TSHR (0.36) TSHR
SCHEMBL21925317 0.77
SCHEMBL9446083 0.77 ACACB (0.39) TSHR

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
EP-1903068-A1 Biodegradable poly(beta-amino esters) and uses thereof Massachusetts Institute of Technology (MIT) (US) 2008-03-26 EP disclosed