SCHEMBL22201502

SCHEMBL22201502

CCC(C)(C)CC(C)(C)COC

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
ALDH1A1 P00352 1/20 0.35
NUDT1 P36639 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
SCHEMBL13400161 0.88
SCHEMBL1508400 0.85
SCHEMBL10794688 0.78 TSHR (0.46) TSHRTDP1ALDH1A1
SCHEMBL20116988 0.77 ALDH1A1 (0.31) TSHRTDP1ALDH1A1
SCHEMBL13820007 0.77
SCHEMBL13067402 0.76 TSHR (0.33) TSHRTDP1ALDH1A1
SCHEMBL1276314 0.75
SCHEMBL18724228 0.72 NUDT1 (0.30) NUDT1
SCHEMBL14813918 0.72
SCHEMBL5084655 0.72 NUDT1 (0.31) NUDT1

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-3677588-A1 MODIFIED OLIGONUCLEOTIDES AND COMPOUND THAT CAN BE USED FOR SYNTHESIZING SAME Guangzhou Ribobio Co., Ltd. (CN) 2020-07-08 EP disclosed