SCHEMBL1805697

SCHEMBL1805697

Cc1c(S(=O)(=O)O)cc(C[NH])cc1S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
RECQL P46063 1/20 0.40
ESR2 Q92731 1/20 0.40
HIF1A Q16665 2/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MYC P01106 1/20 0.32
CDC25A P30304 1/20 0.31
CDC25B P30305 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CASR P41180 1/20 0.31
BRD4 O60885 1/20 0.30

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
SCHEMBL1804207 0.83 POLB (0.38) POLBRECQLESR2HIF1ALMNA
SCHEMBL1804211 0.81 POLB (0.37) POLBRECQLESR2HIF1ALMNA
SCHEMBL1803016 0.80 POLB (0.55) POLBRECQLESR2HIF1ALMNA
SCHEMBL1805703 0.79 POLB (0.36) POLBRECQLESR2HIF1ALMNA
SCHEMBL1805741 0.79 HIF1A (0.35) POLBRECQLESR2HIF1ALMNA
SCHEMBL1805955 0.78 CA2 (0.37) POLBRECQLESR2HIF1ALMNA
SCHEMBL1805954 0.78 POLB (0.36) POLBRECQLESR2HIF1ALMNA
SCHEMBL4968224 0.75 MYC (0.36) POLBRECQLESR2HIF1ALMNA
SCHEMBL7132765 0.75 ALDH1A1 (0.44) POLBRECQLHIF1ALMNAHPGD
SCHEMBL1804051 0.75 ESR2 (0.43) POLBRECQLESR2HIF1ALMNA

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-8404036-B2 Water-soluble near-infrared absorbing coloring matters and aqueous inks containing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-03-26 US disclosed
US-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-05-26 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 (1 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-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME IK, RB1, COL1A1 POLB 3927/4885RECQL 529/4885ESR2 3059/4885

“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.