SCHEMBL32869249

SCHEMBL32869249

O=C1OC(=O)c2ccc(S)c3cccc1c23

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMS P04818 7/20 0.61
TDP1 Q9NUW8 3/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 6/20 0.41
MEN1 O00255 5/20 0.41
POLB P06746 4/20 0.41
MAPT P10636 4/20 0.38
USP2 O75604 4/20 0.38
CYP1A2 P05177 2/20 0.38
RGS12 O14924 1/20 0.38
CYP3A4 P08684 1/20 0.38
PARP1 P09874 1/20 0.38
THRB P10828 1/20 0.38
CYP2C9 P11712 1/20 0.38
APEX1 P27695 1/20 0.38
CASP1 P29466 1/20 0.38
BRCA1 P38398 1/20 0.38
MTOR P42345 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL6291116 1.00 TYMS (0.61) TYMSTDP1ALOX15KMT2AMEN1
SCHEMBL10267341 0.83 TYMS (0.70) TYMSTDP1ALOX15KMT2AMEN1
SCHEMBL18590078 0.78 MEN1 (0.62) TYMSTDP1ALOX15KMT2AMEN1
SCHEMBL19911015 0.78 TYMS (0.63) TYMSTDP1ALOX15KMT2AMEN1
SCHEMBL14399549 0.78 TYMS (0.63) TYMSTDP1ALOX15KMT2AMEN1
SCHEMBL4959190 0.76 TYMS (0.61) TYMSTDP1ALOX15KMT2AMEN1
SCHEMBL29486055 0.76 TYMS (1.00) TYMSTDP1ALOX15KMT2AMEN1
SCHEMBL320954 0.76 TYMS (0.61) TYMSKMT2AMEN1POLBMAPT
SCHEMBL4960377 0.76 TYMS (0.61) TYMSTDP1ALOX15KMT2AMEN1
SCHEMBL31094972 0.76 TYMS (0.61) TYMSTDP1ALOX15KMT2AMEN1

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-115825030-B Method for on-site detection of tryptamine substances by colorimetric-fluorescent dual-mode detection reagent 中国科学院新疆理化技术研究所 2026-03-31 CN disclosed