SCHEMBL28616634

SCHEMBL28616634

CCCCCCCCCCCCCCCCCCC(C)(CCCCCCCCCCCCCCCCCC)O[SiH3]

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
THRB P10828 1/20 0.42
GGPS1 O95749 6/20 0.38
SMPD1 P17405 5/20 0.38
FDPS P14324 9/20 0.37
CES2 O00748 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR3 Q9UBY5 1/20 0.35

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
SCHEMBL6057156 1.00 TSHR (0.42) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL7056923 1.00 TSHR (0.42) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL6057054 0.97 TSHR (0.37) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL27943194 0.95 TSHR (0.35) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL703720 0.92 TSHR (0.32) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL26113457 0.90 TSHR (0.38) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL26113601 0.90 TSHR (0.38) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL3482190 0.87
SCHEMBL7014044 0.87 TSHR (0.33) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL3481656 0.82

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
CN-113164910-A Adsorbents, devices, kits and methods useful for biological sample processing 沃特世科技公司 2021-07-23 CN disclosed