SCHEMBL11211599

SCHEMBL11211599

O=c1cc(Nc2ccccc2)[nH]n1-c1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.46
CYP2C19 P33261 2/20 0.44
PTPRA P18433 1/20 0.41
PTPRB P23467 1/20 0.41
ALKBH5 Q6P6C2 5/20 0.39
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 4/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
HTT P42858 2/20 0.38
PTPN11 Q06124 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
RAB9A P51151 1/20 0.38
NSD2 O96028 1/20 0.38
DUSP3 P51452 1/20 0.38
PTPN5 P54829 1/20 0.38

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
SCHEMBL9330526 0.91 CYP2C19 (0.40) SNCACYP2C19PTPRAPTPRBALKBH5
SCHEMBL7039254 0.84 MAPT (0.50) CYP2C19ALKBH5TSHRSMN1; SMN2MAPT
SCHEMBL8909512 0.82 ALKBH5 (0.54) CYP2C19ALKBH5TSHRMAPTKMT2A
SCHEMBL11811879 0.82 CA12 (0.45) MAPTKMT2ALMNAMEN1NSD2
SCHEMBL11494744 0.78 CYP2C19 (0.40) CYP2C19ALKBH5TSHRSMN1; SMN2MAPT
SCHEMBL11496671 0.77 ALKBH5 (0.40) CYP2C19ALKBH5TSHRSMN1; SMN2MAPT
SCHEMBL11429334 0.77 MAPT (0.63) CYP2C19TSHRSMN1; SMN2MAPTKMT2A
SCHEMBL8418696 0.77 MAPT (0.59) CYP2C19ALKBH5TSHRSMN1; SMN2MAPT
SCHEMBL9763528 0.76 ALKBH5 (0.50) CYP2C19ALKBH5TSHRSMN1; SMN2MAPT
SCHEMBL11489782 0.74 CYP2C19 (0.41) CYP2C19ALKBH5TSHRSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4418037-A PYROGALLOL DERIVATIVE STORAGE STABILIZER FUJI PHOTO FILM CO., LTD. (JP) 1983-11-29 US disclosed
US-4188489-A Process for the production of 3-substituted amino-5-pyrazolones FUJI PHOTO FILM CO., LTD. (JP) 1980-02-12 US disclosed
US-4067738-A PYRAZOLONE DYES, OXAZOLINE DYES FUJI PHOTO FILM CO., LTD. 1978-01-10 US disclosed