SCHEMBL9863375

SCHEMBL9863375

CN(C)S(=O)(=O)c1ccc(-c2cnc(CP(=O)(O)O)o2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA4 P22748 1/20 0.40
LMNA P02545 4/20 0.40
NPC1 O15118 4/20 0.40
MAPT P10636 2/20 0.40
TP53 P04637 2/20 0.40
CA9 Q16790 1/20 0.40
NOTUM Q6P988 2/20 0.39
RXRA P19793 2/20 0.38
RXRB P28702 2/20 0.38
RXRG P48443 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PAX8 Q06710 1/20 0.38
KCNH2 Q12809 1/20 0.37
HSD17B10 Q99714 1/20 0.36
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTT P42858 2/20 0.36

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
SCHEMBL9863460 0.83 LMNA (0.38) CA12CA1CA2CA4LMNA
SCHEMBL9863536 0.82 CA12 (0.43) CA12CA1CA2CA4LMNA
SCHEMBL20600303 0.68 FFAR1 (0.52) NPC1MAPTTP53NOTUMRXRA
SCHEMBL5890969 0.65 LMNA (0.64) CA12CA1CA2CA4LMNA
SCHEMBL5891165 0.65 LMNA (0.64) CA12CA1CA2CA4LMNA
SCHEMBL5477380 0.65 KDR (0.71)
SCHEMBL20583110 0.63 CDK2 (0.40) HDAC4HDAC6
SCHEMBL21244024 0.62 LMNA (0.59) CA12CA1CA2CA4LMNA
SCHEMBL344819 0.62 CA12 (0.73) CA12CA1CA2LMNANPC1
SCHEMBL22575150 0.61 SMN1; SMN2 (0.53) LMNANPC1MAPTTP53L3MBTL1

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
US-5041567-A Human and veterianary medicine; veneral diseases respiratory diseases, bovine mastitis BEECHAM GROUP PLC (GB) 1991-08-20 US disclosed