SCHEMBL8380244

SCHEMBL8380244

O=S(=O)(O)c1ccc2c(c1)ncn2S

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.36
HSD17B10 Q99714 3/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 7/20 0.34
TSHR P16473 5/20 0.34
HTT P42858 4/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 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
SCHEMBL7762865 0.83 LMNA (0.38) ALDH1A1LMNATSHRHTTSMN1; SMN2
SCHEMBL5339617 0.80 ALDH1A1 (0.51) ALDH1A1HSD17B10KDM4ELMNAHTT
SCHEMBL374942 0.75 FGFR1 (0.61) ALDH1A1HTTHPGD
SCHEMBL3837069 0.74 HDAC1 (0.51) ALDH1A1HSD17B10KDM4ELMNAHTT
Hydrochloric Acid SCHEMBL1276068 0.74 FGFR1 (0.60) ALDH1A1LMNAHTTSMN1; SMN2HPGD
Pyrrole SCHEMBL10572488 0.73 HDAC1 (0.47) ALDH1A1KDM4ESMN1; SMN2KMT2AHDAC6
SCHEMBL10465628 0.71 FGFR1 (0.60) ALDH1A1HSD17B10LMNATSHRGAA
SCHEMBL6227705 0.70 DYRK1A (0.45) ALDH1A1LMNAHTTKMT2AHDAC6
SCHEMBL1975997 0.69 FGFR1 (0.54) ALDH1A1HSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL824443 0.69 ALDH1A1 (0.38) ALDH1A1HSD17B10KDM4ELMNATSHR

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-5871893-A LEUCO DYE KONICA CORPORATION (JP) 1999-02-16 US disclosed