SCHEMBL4280752

SCHEMBL4280752

O=S(=O)(O)c1ccc(N=Nc2ccc(O)c(O)c2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 4/20 0.74
PTGS2 P35354 4/20 0.74
POLB P06746 2/20 0.61
CYP2D6 P10635 2/20 0.61
RPS6KA3 P51812 1/20 0.59
BRD4 O60885 1/20 0.54
PHLPP2 Q6ZVD8 4/20 0.51
CYP2C9 P11712 3/20 0.51
ALDH1A1 P00352 3/20 0.51
HSD17B10 Q99714 3/20 0.51
ATIC P31939 1/20 0.51
CYP1A2 P05177 2/20 0.50
GLO1 Q04760 2/20 0.50
CA12 O43570 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
CA7 P43166 1/20 0.50
PLCG1 P19174 1/20 0.50
LMNA P02545 1/20 0.47
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL11578943 0.84 HSD17B10 (0.66) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL4842357 0.84 POLB (0.56) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL11219752 0.84 HSD17B10 (0.66) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL7813054 0.84 RPS6KA3 (0.63) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL11649642 0.84 PTGS1 (0.58) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL8844893 0.84 PTGS2 (0.77) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL7813050 0.84 RPS6KA3 (0.63) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL8844886 0.84 PTGS2 (0.77) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL18624977 0.84 POLB (0.83) PTGS1PTGS2POLBCYP2D6RPS6KA3
SCHEMBL28560987 0.84 POLB (0.83) PTGS1PTGS2POLBCYP2D6RPS6KA3

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
US-8710354-B2 Solar cell with hyperpolarizable absorber HONEYWELL INTERNATIONAL INC. (US) 2014-04-29 US disclosed
US-8710354-B2 Solar cell with hyperpolarizable absorber HONEYWELL INTERNATIONAL INC. (US) 2014-04-29 US disclosed
US-20090159124-A1 SOLAR CELL HYPERPOLARIZABLE ABSORBER HONEYWELL INTERNATIONAL INC. (US) 2009-06-25 US disclosed
US-4050945-A METALLIC COMPOUND REACTANT, CHELATING COMPOUND REACTANT, BINDER SUZUKI YOSHIO 1977-09-27 US disclosed