SCHEMBL667158

SCHEMBL667158

O=S(=O)(O)c1cc(N=C=S)cc2c(S(=O)(=O)O)cccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAD1 O60671 1/20 0.52
▸ P2RY6 Q15077 1/20 0.52
▸ SENP2 Q9HC62 4/20 0.50
▸ ATIC P31939 3/20 0.50
▸ SUMO2 P61956 3/20 0.50
▸ SUMO1 P63165 3/20 0.50
▸ SENP7 Q9BQF6 3/20 0.50
▸ TTR P02766 1/20 0.46
▸ CYP1A2 P05177 3/20 0.40
▸ SENP1 Q9P0U3 3/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ TDP1 Q9NUW8 3/20 0.39
▸ MPL P40238 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ USP2 O75604 2/20 0.39
▸ LTA P01374 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39

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
SCHEMBL14528331 0.80 SUMO2 (0.53) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL17323119 0.77 SUMO2 (0.61) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL14546743 0.77 SENP2 (0.61) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL127423 0.76 TTR (0.72) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL1121128 0.76 TTR (0.72) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL28290095 0.76 TTR (0.72) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL3905753 0.75 CYP1A2 (0.52) RAD1P2RY6SENP2ATICSUMO2
Water SCHEMBL26654218 0.74 TTR (0.69) SENP2ATICSUMO2SUMO1SENP7
Water SCHEMBL3919443 0.74 TTR (0.69) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL29363198 0.74 TTR (0.75) SENP2ATICSUMO2SUMO1SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9513284-B2 Pyrenyloxysulfonic acid fluorescent agents Life Technologies Corporation (US) 2016-12-06 — — US disclosed
US-20140193926-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS Life Technologies Corporation (US) 2014-07-10 — — US disclosed
US-8614294-B2 Pyrenyloxysulfonic acid fluorescent agents Life Technologies Corporation (US) 2013-12-24 — — US disclosed
US-20130079497-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS Life Technologies Corporation (US) 2013-03-28 — — US disclosed
US-8268886-B2 Pyrenyloxysulfonic acid fluorescent agents Life Technologies Corporation (US) 2012-09-18 — — US disclosed
US-20120045848-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS Life Technologies Corporation (US) 2012-02-23 — — US disclosed
US-8039642-B2 Pyrenyloxysulfonic acid fluorescent agents Life Technologies Corporation (US) 2011-10-18 — — US disclosed
US-20080032379-A1 PYRENYLOXYSULFONIC ACID FLURESCENT AGENTS INVITROGEN CORPORATION (US) 2008-02-07 — — US disclosed
WO-2005064336-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS MOLECULAR PROBES, INC. (US) 2005-07-14 — — WO disclosed
US-20050123935-A1 Pyrenyloxysulfonic acid fluorescent agents MOLECULAR PROBES, INC. 2005-06-09 — — US disclosed
US-5132432-A Reactive fluorescent dyes for use as tracers MOLECULAR PROBES, INC. (US) 1992-07-21 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120045848-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS NOP56, ANXA5, ANXA6 RAD1 3896/4885P2RY6 145/4885SENP2 4381/4885
US-20130079497-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS NOP56, ANXA5, ANXA6 RAD1 3896/4885P2RY6 145/4885SENP2 4381/4885
US-20080032379-A1 PYRENYLOXYSULFONIC ACID FLURESCENT AGENTS NOP56, ANXA5, PFAS RAD1 3892/4885P2RY6 37/4885SENP2 4645/4885
US-20050123935-A1 Pyrenyloxysulfonic acid fluorescent agents NOP56, ANXA5, ANXA6 RAD1 3896/4885P2RY6 145/4885SENP2 4381/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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