SCHEMBL1804208

SCHEMBL1804208

C[N]c1cc(Cl)ccc1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NSD2 O96028 1/20 0.41
▸ MMP14 P50281 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ GRIK1 P39086 1/20 0.40
▸ GRIK2 Q13002 1/20 0.40
▸ TRPV4 Q9HBA0 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ CCR2 P41597 2/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ HSD11B1 P28845 2/20 0.34
▸ SUMO2 P61956 2/20 0.34
▸ SUMO1 P63165 2/20 0.34
▸ SENP7 Q9BQF6 2/20 0.34
▸ SENP2 Q9HC62 2/20 0.34
▸ SENP1 Q9P0U3 2/20 0.34
▸ SENP3 Q9H4L4 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL1807104 0.85 NSD2 (0.44) NSD2MMP14CASP6GRIK1GRIK2
SCHEMBL1808666 0.79 MPL (0.44) CASP6ALDH1A1CYP2C9SUMO2SUMO1
SCHEMBL4448109 0.76 TRPV4 (0.40) NSD2MMP14CASP6GRIK1GRIK2
SCHEMBL1804052 0.75 MPL (0.41) ALDH1A1L3MBTL1GAAMAPTHPGD
SCHEMBL4501445 0.75 GAA (0.50) GRIK1GRIK2TRPV4ALDH1A1L3MBTL1
SCHEMBL30678861 0.74 HSD11B1 (0.45) GRIK1GRIK2TRPV4CYP2C9HSD11B1
SCHEMBL2841309 0.74 S100A4 (0.48) GRIK1GRIK2TRPV4ALDH1A1CYP2C9
SCHEMBL1729184 0.74 HSD11B1 (0.45) GRIK1GRIK2TRPV4CYP2C9HSD11B1
Hydrochloric Acid SCHEMBL3919077 0.73 GAA (0.49) GRIK1GRIK2TRPV4ALDH1A1L3MBTL1
SCHEMBL8716074 0.72 HSD11B1 (0.44) GRIK1GRIK2TRPV4ALDH1A1CYP2C9

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 NSD2 1137/4885MMP14 2903/4885CASP6 4737/4885

“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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