SCHEMBL31258323

SCHEMBL31258323

COC(=O)c1ccc2snnc2c1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.68
ALDH1A1 P00352 3/20 0.66
MAPT P10636 8/20 0.65
POLB P06746 5/20 0.65
BLM P54132 1/20 0.65
NPC1 O15118 6/20 0.61
SMN1; SMN2 Q16637 6/20 0.61
RAB9A P51151 5/20 0.61
TDP1 Q9NUW8 1/20 0.58
TP53 P04637 4/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MLLT1 Q03111 1/20 0.55

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
SCHEMBL4277300 1.00 THRB (0.68) THRBALDH1A1MAPTPOLBBLM
SCHEMBL507588 0.87 NSD2 (0.65) THRBALDH1A1MAPTPOLBBLM
SCHEMBL7463215 0.83 MAPT (0.72) THRBALDH1A1MAPTPOLBNPC1
SCHEMBL12640261 0.81 MAPT (0.71) THRBALDH1A1MAPTPOLBNPC1
SCHEMBL14587281 0.81 THRB (1.00) THRBALDH1A1MAPTPOLBNPC1
SCHEMBL593649 0.80 THRB (0.66) THRBALDH1A1MAPTPOLBNPC1
SCHEMBL16859132 0.79 THRB (0.57) THRBALDH1A1MAPTPOLBBLM
Methyl Benzoate SCHEMBL28938054 0.78 TSHR (0.58) THRBALDH1A1MAPTPOLBBLM
SCHEMBL1022265 0.78 THRB (0.64) THRBALDH1A1MAPTPOLBNPC1
SCHEMBL20364679 0.77 THRB (0.63) THRBALDH1A1MAPTPOLBNPC1

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-119275347-A Electrolyte, preparation method thereof and battery 惠州亿纬动力电池有限公司 2025-01-07 CN disclosed