SCHEMBL1809342

SCHEMBL1809342

O=S(=O)(O)c1cccc2c(Cl)cc(Cl)c(O)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.46
ATIC P31939 1/20 0.42
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
HTT P42858 2/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
ALOX15B O15296 1/20 0.40
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTR1A P08908 1/20 0.40
ALOX5 P09917 1/20 0.40
MMP9 P14780 1/20 0.40

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
SCHEMBL1808663 0.87 CDK2 (0.51) TTRKDM4EMEN1ALDH1A1MAPT
SCHEMBL1809341 0.83 TTR (0.46) TTRATICAURKAAURKBMEN1
SCHEMBL14059358 0.79 TTR (0.47) TTRATICAURKAAURKBKDM4E
SCHEMBL1805338 0.78 AURKA (0.49) TTRATICAURKAAURKBKDM4E
SCHEMBL9189207 0.77 AURKA (0.47) TTRATICAURKAAURKBKDM4E
SCHEMBL13515228 0.76 AURKA (0.50) TTRATICAURKAAURKBTDP1
SCHEMBL10485225 0.75 CYP1A2 (0.51) TTRATICAURKAAURKBCYP1A2
SCHEMBL10424564 0.75 ATIC (0.52) TTRATICAURKAAURKBMEN1
SCHEMBL3194355 0.75 AURKA (0.57) TTRATICAURKAAURKBKDM4E
SCHEMBL1805337 0.75 TTR (0.43) TTRATICAURKAAURKBKDM4E

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 TTR 594/4885ATIC 1752/4885AURKA 2276/4885

“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.