SCHEMBL84337

SCHEMBL84337

Cc1nc2cc(S(=O)(=O)O)ccc2s1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.66
ALDH1A1 P00352 6/20 0.65
SMN1; SMN2 Q16637 7/20 0.57
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
PKM P14618 5/20 0.54
HSD17B10 Q99714 2/20 0.53
TP53 P04637 3/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
LMNA P02545 7/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HTT P42858 5/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.44
NOD2 Q9HC29 1/20 0.44

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
Hydrochloric Acid SCHEMBL27712068 0.98 POLB (0.64) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL83871 0.87 LMNA (0.57) POLBALDH1A1SMN1; SMN2PKMLMNA
Hydrochloric Acid SCHEMBL28774873 0.85 LMNA (0.56) POLBALDH1A1SMN1; SMN2PKMLMNA
SCHEMBL6141396 0.85 POLB (0.68) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL14620302 0.84 ALDH1A1 (0.49) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL3524765 0.83 POLB (0.66) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL14612413 0.83 POLB (0.66) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11153027 0.83 ALDH1A1 (0.55) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL6523274 0.81 CA2 (0.51) POLBALDH1A1PKMHSD17B10GAA
SCHEMBL4055826 0.81 SMN1; SMN2 (0.57) POLBALDH1A1SMN1; SMN2NPC1RAB9A

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 76 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919333-B2 Bis-transition-metal-chelate probes RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2005-07-19 US claimed
WO-2005029075-A1 BIS-TRANSITION-METAL-CHELATE PROBES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2005-03-31 WO claimed
EP-1506402-A2 BIS-TRANSITION-METAL-CHELATE-PROBES Rutgers, The State University of New Jersey (US) 2005-02-16 EP claimed
US-20040096887-A1 Bis-transition-metal-chelate probes RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2004-05-20 US claimed
US-20040019104-A1 Reagents and procedures for high-specificity labeling RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2004-01-29 US claimed
WO-2003107010-A1 REAGENTS AND PROCEDURES FOR HIGH-SPECIFICITY LABELING RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2003-12-24 WO claimed
WO-2003091689-A2 BIS-TRANSITION-METAL-CHELATE-PROBES RUTGERS, THE STATE OF UNIVERSITY OF NEW JERSEY (US) 2003-11-06 WO claimed
US-10703910-B2 Coloring composition, ink jet recording ink, ink jet recording method, and ink jet printer cartridge FUJIFILM CORPORATION (JP) 2020-07-07 US disclosed
EP-3421547-A1 COLORING COMPOSITION, INKJET RECORDING INK, INKJET RECORDING METHOD, AND INKJET PRINTER CARTRIDGE FUJIFILM Corporation (JP) 2019-01-02 EP disclosed
US-9850382-B1 Unsymmetrical cyanine dyes and their application Ying, Laiqiang (US) 2017-12-26 US disclosed
EP-1377640-B1 AZO COMPOUNDS AND PROCESS OF PRODUCING THE SAME AND NOVEL INTERMEDIATE COMPOUNDS USED IN THE PROCESS OF PRODUCING AZO COMPOUNDS FUJIFILM CORP (JP) 2017-05-17 EP disclosed
US-9023138-B2 Compound having xanthene skeleton, coloring composition, ink for ink jet recording and ink jet recording method FUJIFILM CORPORATION (JP) 2015-05-05 US disclosed
US-9023139-B2 Coloring composition, ink for inkjet recording and inkjet recording method FUJIFILM CORPORATION (JP) 2015-05-05 US disclosed
WO-2005029075-A1 BIS-TRANSITION-METAL-CHELATE PROBES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2005-03-31 WO disclosed
EP-1506402-A2 BIS-TRANSITION-METAL-CHELATE-PROBES Rutgers, The State University of New Jersey (US) 2005-02-16 EP disclosed
US-20050031545-A1 Bis-transition-metal-chelate probes RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2005-02-10 US disclosed
US-20040096887-A1 Bis-transition-metal-chelate probes RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2004-05-20 US disclosed
US-20040019104-A1 Reagents and procedures for high-specificity labeling RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2004-01-29 US disclosed
WO-2003107010-A1 REAGENTS AND PROCEDURES FOR HIGH-SPECIFICITY LABELING RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2003-12-24 WO disclosed
WO-2003091689-A2 BIS-TRANSITION-METAL-CHELATE-PROBES RUTGERS, THE STATE OF UNIVERSITY OF NEW JERSEY (US) 2003-11-06 WO 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 (3 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-20050031545-A1 Bis-transition-metal-chelate probes SCO2, CDY1; CDY1B, CDYL POLB 837/4885ALDH1A1 1728/4885SMN1; SMN2 4584/4885
US-20040096887-A1 Bis-transition-metal-chelate probes SCO2, CDY1; CDY1B, PYM1 POLB 834/4885ALDH1A1 1285/4885SMN1; SMN2 4414/4885
US-20040019104-A1 Reagents and procedures for high-specificity labeling AS3MT, SRMS, HNRNPH3 POLB 1664/4885ALDH1A1 3876/4885SMN1; SMN2 1708/4885

“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.