SCHEMBL30200215

SCHEMBL30200215

C=Cc1ccc(C[S+](C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TSHR P16473 1/20 0.39
HDAC8 Q9BY41 1/20 0.38
TDP1 Q9NUW8 2/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
POLB P06746 1/20 0.31
TRPA1 O75762 1/20 0.31

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
Hydrochloric Acid SCHEMBL30093040 0.98 ALDH1A1 (0.48) ALDH1A1TSHRHDAC8TDP1CHRNB2
SCHEMBL30200152 0.78 ALDH1A1 (0.46) ALDH1A1TSHRHDAC8TDP1CHRNB2
Butane SCHEMBL28268770 0.75 ALDH1A1 (0.69) ALDH1A1TSHRHDAC8TDP1CHRNB2
SCHEMBL8720270 0.73
SCHEMBL15915 0.73 ALDH1A1 (0.58) ALDH1A1TSHRHDAC8CHRNB2CHRNB4
SCHEMBL13109192 0.73 ALDH1A1 (0.50) ALDH1A1TSHRHDAC8TDP1CHRNB2
SCHEMBL1119853 0.73 ALDH1A1 (0.50) ALDH1A1TSHRHDAC8TDP1CHRNB2
SCHEMBL30200141 0.72 ALDH1A1 (0.39) ALDH1A1TSHRHDAC8TDP1CHRNB2
SCHEMBL1647493 0.72 ALDH1A1 (0.65) ALDH1A1TSHRHDAC8TDP1CHRNB2
SCHEMBL50300 0.72 ALDH1A1 (0.65) ALDH1A1TSHRHDAC8TDP1CHRNB2

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-20230101362-A1 RNA STABILIZATION TEAM MEDICAL LLC 2023-03-30 US disclosed
WO-2023044455-A2 RNA STABILIZATION TEAM MEDICAL LLC (US) 2023-03-23 WO disclosed