SCHEMBL28897130

SCHEMBL28897130

COC(=O)CCS(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.53
▸ HTT P42858 2/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ MMP1 P03956 2/20 0.51
▸ GAA P10253 3/20 0.50
▸ MEN1 O00255 2/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ DHFR P00374 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ POLB P06746 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ F2 P00734 1/20 0.45
▸ PRSS1 P07477 1/20 0.45
▸ PRSS2 P07478 1/20 0.45
▸ PRSS3 P35030 1/20 0.45
▸ PKM P14618 1/20 0.45

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
SCHEMBL7874157 0.85 KMT2A (0.71) KMT2AGAAALDH1A1LMNAPOLB
SCHEMBL7867055 0.84 LMNA (0.55) KMT2AGAAALDH1A1LMNASMN1; SMN2
SCHEMBL10280755 0.84 PSIP1 (0.54) KMT2AHTTNPSR1MMP1GAA
SCHEMBL7874068 0.83 POLB (0.59) KMT2AMMP1MEN1ALDH1A1LMNA
SCHEMBL7870908 0.83 ALDH1A1 (0.62) KMT2AHTTNPSR1MMP1GAA
SCHEMBL7874047 0.83 KMT2A (0.53) KMT2AHTTNPSR1MMP1GAA
SCHEMBL17550651 0.83 GAA (0.53) KMT2AMMP1GAAALDH1A1DHFR
SCHEMBL28101227 0.83 MAPT (0.59) KMT2AHTTNPSR1MMP1LMNA
Hydrochloric Acid SCHEMBL160719 0.83 PSIP1 (0.53) KMT2AHTTNPSR1MMP1GAA
SCHEMBL16144557 0.82 KMT2A (0.57) KMT2AHTTNPSR1MMP1GAA

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-114341637-A Immunosensor 联邦科学工业研究组织 2022-04-12 — — CN disclosed
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