SCHEMBL7754889

SCHEMBL7754889

O=S(=O)(O)c1ccc(-c2ccc(O)c(-n3nc4ccccc4n3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.52
RAB9A P51151 5/20 0.52
LMNA P02545 2/20 0.52
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 3/20 0.39
MAPT P10636 3/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 4/20 0.37
HSD17B10 Q99714 2/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
TSHR P16473 1/20 0.37
CA2 P00918 3/20 0.36
CA9 Q16790 3/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
ALOX5 P09917 1/20 0.34

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
SCHEMBL30683811 0.88 NPC1 (0.58) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL1703200 0.84 LMNA (0.63) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL13412684 0.80 NPC1 (0.77) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL9284695 0.78 NPC1 (0.60) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL8088622 0.74 NPC1 (0.62) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL9189241 0.74 KMT2A (0.44) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL9188428 0.74 NPC1 (0.50) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL1702661 0.72 LMNA (0.49) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL18928204 0.72 KDM4E (0.44) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL7857203 0.72 NPC1 (0.69) NPC1RAB9ALMNAMEN1KMT2A

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-2001019681-A SULFONATED BENZOTRIAZOLE-BASED COMPOUND OSAKA SEIKA KOGYO KK 2001-01-23 JP disclosed