SCHEMBL1805742

SCHEMBL1805742

C[N]c1cc(S(=O)(=O)O)c(OC)c(S(=O)(=O)O)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MPL P40238 2/20 0.33
▸ RAD1 O60671 1/20 0.33
▸ P2RY6 Q15077 1/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ KDM4E B2RXH2 4/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ PTGS2 P35354 1/20 0.31
▸ ATIC P31939 1/20 0.31
▸ SUMO2 P61956 1/20 0.31
▸ SUMO1 P63165 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP2 Q9HC62 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL1805699 0.78 BRD4 (0.38) RAD1P2RY6ALDH1A1KDM4EHPGD
SCHEMBL1807377 0.77 SMN1; SMN2 (0.46) MPLALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1805064 0.75 PRMT1 (0.37) MPLALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1803742 0.74 HIF1A (0.36) MPLALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1803744 0.73 MAPT (0.49) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL1803632 0.73 HTR2A (0.53) KDM4EHTR2CLMNAKMT2A
SCHEMBL1803312 0.73 PTGS2 (0.44) MPLALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1805741 0.72 HIF1A (0.35) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL1805744 0.72 LOXL2 (0.37) ALDH1A1KDM4EHTR2CLMNAMAPT
SCHEMBL1806892 0.70 CA12 (0.41) ALDH1A1HTR2CLMNAMAPTKMT2A

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 MPL 4659/4885RAD1 1510/4885P2RY6 4343/4885

“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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