SCHEMBL1808668

SCHEMBL1808668

Cc1ccc(S(=O)(=O)O)c(CN)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
RECQL P46063 1/20 0.40
CASP6 P55212 1/20 0.40
ELAVL1 Q15717 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEP1B Q16820 2/20 0.36
MYC P01106 1/20 0.36
HSD17B10 Q99714 2/20 0.36
RAPGEF4 Q8WZA2 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35

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
SCHEMBL3975257 0.86 TAAR1 (0.55) TAAR1ALDH1A1GAAMEN1KMT2A
SCHEMBL1805251 0.85 ALDH1A1 (0.40) TAAR1ALDH1A1GAAMEN1KMT2A
SCHEMBL30716894 0.85 AMY1A (0.44) TAAR1ALDH1A1GAAMEN1KMT2A
SCHEMBL1607815 0.85 RAPGEF4 (0.44) ALDH1A1GAAMEN1KMT2AKDM4E
SCHEMBL14991279 0.85 AMY1A (0.44) TAAR1ALDH1A1GAAMEN1KMT2A
SCHEMBL30823619 0.85 GAA (0.41) TAAR1ALDH1A1GAAMEN1KMT2A
SCHEMBL30236538 0.85 RAPGEF4 (0.44) ALDH1A1GAAMEN1KMT2AKDM4E
SCHEMBL1180196 0.85 GAA (0.41) TAAR1ALDH1A1GAAMEN1KMT2A
SCHEMBL1806437 0.83 MPL (0.38) ALDH1A1GAAMEN1KMT2AKDM4E
SCHEMBL1806434 0.83 ALDH1A1 (0.37) TAAR1ALDH1A1GAAMEN1KMT2A

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 TAAR1 1933/4885ALDH1A1 218/4885GAA 2451/4885

“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.