SCHEMBL27596496

SCHEMBL27596496

Cc1ccc(F)cc1N=S(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ MMP14 P50281 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ KEAP1 Q14145 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ PMM2 O15305 1/20 0.33
▸ G6PD P11413 1/20 0.33
▸ MPI P34949 1/20 0.33
▸ PHOSPHO1 Q8TCT1 1/20 0.33
▸ APOBEC3G Q9HC16 1/20 0.33
▸ CYP3A4 P08684 2/20 0.32

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
SCHEMBL12239458 0.77 TRPA1 (0.35) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL16502301 0.72 ACHE (0.35) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL1022418 0.72 CYP3A4 (0.63) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL11387301 0.70 TSHR (0.41) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL1020719 0.68 ALDH1A1 (0.46) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL29401800 0.68 ALDH1A1 (0.46) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL28108539 0.68 MAPT (0.36) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL11057456 0.67 NPC1 (0.46) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL20117456 0.65 MEN1 (0.31) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL3924020 0.65 HDAC4 (0.35) SMN1; SMN2KMT2ANPC1RAB9AMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100369899-C Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2008-02-20 — — CN disclosed
CN-1642922-A Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2005-07-20 — — CN disclosed
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