SCHEMBL31529973

SCHEMBL31529973

CCCC[Al](CCCC)CCCC.[O-2]

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.43
LMNA P02545 3/20 0.43
THRB P10828 1/20 0.40
ALDH1A1 P00352 4/20 0.33
TDP1 Q9NUW8 1/20 0.33
SLC22A1 O15245 2/20 0.32
SLC22A2 O15244 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CA1 P00915 1/20 0.30
DNM1 Q05193 4/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL15454 0.96 TSHR (0.46) TSHRLMNATHRBALDH1A1TDP1
Bromide SCHEMBL6048229 0.92 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL16180725 0.92 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL8154778 0.92 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
Hydrochloric Acid SCHEMBL22638177 0.92 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL8154782 0.92 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL27835200 0.92 TSHR (0.43) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL2214339 0.89 TSHR (0.40) TSHRLMNATHRBALDH1A1TDP1
SCHEMBL6694665 0.89 TSHR (0.47) TSHRLMNATHRBALDH1A1SLC22A1
SCHEMBL6235894 0.89 TSHR (0.47) TSHRLMNATHRBALDH1A1SLC22A1

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-119841615-A Ceramic-based aerogel and preparation method thereof 安翼陶基新材料科技(淄博)有限公司 2025-04-18 CN disclosed