SCHEMBL5888397

SCHEMBL5888397

Nc1cccc(/N=N/c2cccc(S(=O)(=O)O)c2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.70
ALDH1A1 P00352 1/20 0.70
TSHR P16473 1/20 0.70
HSD17B10 Q99714 1/20 0.70
SENP3 Q9H4L4 2/20 0.61
SENP2 Q9HC62 2/20 0.61
SENP1 Q9P0U3 2/20 0.61
SUMO2 P61956 1/20 0.61
SUMO1 P63165 1/20 0.61
SENP7 Q9BQF6 1/20 0.61
CA12 O43570 4/20 0.57
CA2 P00918 4/20 0.57
CA9 Q16790 4/20 0.57
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
MAPK1 P28482 1/20 0.52
KMT2A Q03164 1/20 0.52
GLO1 Q04760 6/20 0.51
POLB P06746 1/20 0.49
CYP2D6 P10635 1/20 0.49

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
SCHEMBL5888399 1.00 TDP1 (0.70) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL3308193 0.89 SENP3 (0.62) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL3308195 0.89 SENP3 (0.62) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL5888705 0.88 CA12 (0.73) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL5888710 0.88 CA12 (0.73) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL28555423 0.87 CA12 (0.71) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL10800727 0.84 POLB (0.69) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL10800723 0.84 POLB (0.69) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL29627059 0.84 SENP3 (0.57) TDP1ALDH1A1TSHRHSD17B10SENP3
SCHEMBL29044 0.83 TSHR (1.00) TDP1ALDH1A1TSHRHSD17B10CA12

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
US-7022331-B2 Thermochromic/photochromic cosmetic compositions Theisen, Lyle (US) 2006-04-04 US disclosed
US-20020192247-A1 Thermochromic/photochromic cosmetic compositions THEISEN LYLE (US) 2002-12-19 US disclosed