SCHEMBL21803201

SCHEMBL21803201

Cc1ccc(S(=O)(=O)OCc2cccs2)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
ALDH1A1 P00352 5/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 1/20 0.43
SLC6A3 Q01959 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.41
HPGD P15428 2/20 0.41
TRPM8 Q7Z2W7 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL1418052 0.85 MEN1 (0.46) RAB9ANPC1MEN1LMNAKMT2A
SCHEMBL13992214 0.82 MEN1 (0.47) RAB9ANPC1MEN1LMNAKMT2A
SCHEMBL13992225 0.82 MEN1 (0.44) RAB9ANPC1MEN1LMNAKMT2A
SCHEMBL13270215 0.82 NPSR1 (0.51) RAB9ANPC1MEN1LMNAKMT2A
SCHEMBL9685444 0.77 MEN1 (0.44) RAB9ANPC1MEN1LMNAKMT2A
SCHEMBL1367928 0.76 ALDH1A1 (0.44) RAB9ANPC1MEN1LMNAKMT2A
SCHEMBL16544564 0.76 STAT3 (0.39) MEN1KMT2AALDH1A1TRPM8
SCHEMBL7381563 0.76 ALDH1A1 (0.56) RAB9ANPC1MEN1LMNAKMT2A
SCHEMBL8061919 0.75 VDR (0.47) MEN1LMNAKMT2AALDH1A1MAPK1
SCHEMBL6859827 0.74 CA2 (0.63) MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3744810-B1 FLUORESCENT DYE, PREPARATION METHOD THEREFOR AND USE THEREOF UNIV SHENZHEN (CN) 2022-06-01 EP disclosed
US-10889719-B2 Fluorescent dye, preparation method therefor and use thereof SHENZHEN UNIVERSITY (CN) 2021-01-12 US disclosed
EP-3744810-A1 FLUORESCENT DYE, PREPARATION METHOD THEREFOR AND USE THEREOF Shenzhen University (CN) 2020-12-02 EP disclosed
US-20200095425-A1 FLUORESCENT DYE, PREPARATION METHOD THEREFOR AND USE THEREOF SHENZHEN UNIVERSITY (CN) 2020-03-26 US disclosed