SCHEMBL7799771

SCHEMBL7799771

NCC(=O)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
PLK1 P53350 1/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
HTR6 P50406 7/20 0.62
AKR1C3 P42330 1/20 0.61
AKR1C1 Q04828 1/20 0.61
TNF P01375 5/20 0.58
TNFSF11 O14788 4/20 0.55
ALOX5 P09917 1/20 0.52
PTGS2 P35354 1/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50

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
SCHEMBL12908807 0.90 HTR6 (0.62) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL27622290 0.86 LMNA (0.72) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL4926276 0.84 LMNA (0.74) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL948989 0.84 AKR1C3 (0.83) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL8998784 0.81 LMNA (0.74) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL30393652 0.81 LMNA (1.00) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL949716 0.81 LMNA (1.00) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL13485750 0.79 PLK1 (0.78) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL9591955 0.79 LMNA (0.70) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL2886421 0.78 KMT2A (1.00) LMNASMN1; SMN2PLK1MEN1KMT2A

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
JP-2001097948-A COMPOUND HAVING AFFINITY FOR THROMBOPOIETIN RECEPTOR TORII YAKUHIN KK 2001-04-10 JP disclosed