SCHEMBL23977166

SCHEMBL23977166

NCCS(=O)(=O)c1cc(S(=O)(=O)CCN)cc(S(=O)(=O)CCN)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.39
CYP2C19 P33261 2/20 0.39
LMNA P02545 1/20 0.39
SLC6A6 P31641 1/20 0.39
BLM P54132 1/20 0.39
CA2 P00918 9/20 0.37
CA1 P00915 3/20 0.35
ALDH1A1 P00352 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CA12 O43570 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33
CA5A P35218 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
PSIP1 O75475 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL1540593 0.77 PSIP1 (0.56) CA2CA1CA12CA4CA6
Hydrochloric Acid SCHEMBL1977191 0.75 PSIP1 (0.54) CA2CA1CA12CA4CA6
SCHEMBL10702964 0.75 GAA (0.59) CYP2C19LMNACA2CA1ALDH1A1
SCHEMBL1939594 0.74 NPC1 (0.55) CA2CA1ALDH1A1CYP3A4CA12
SCHEMBL22015784 0.74 KMT2A (0.47) CYP2C19CA2CA1ALDH1A1CYP3A4
SCHEMBL2778514 0.74 ALDH1A1 (0.69) CYP2C19LMNACA2CA1ALDH1A1
SCHEMBL13586189 0.74 PLCG1 (0.61) CYP2C19LMNACA2CA1ALDH1A1
SCHEMBL4365964 0.74 CA2 (0.39) LOXL2CYP2C19LMNASLC6A6BLM
SCHEMBL6752574 0.74 CA2 (0.59) CYP2C19LMNABLMCA2CA1
SCHEMBL10634307 0.72 LMNA (0.40) LOXL2CYP2C19LMNACA2ALDH1A1

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
WO-2021220011-A1 ANTI-INFECTIVE BICYCLIC PEPTIDE CONJUGATES BICYCLETX LIMITED (GB) 2021-11-04 WO disclosed