SCHEMBL1807475

SCHEMBL1807475

Cc1c(CCO)cccc1S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.39
TTR P02766 2/20 0.37
CYP1A2 P05177 1/20 0.35
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
SNCA P37840 1/20 0.33
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
FABP4 P15090 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
MAPK14 Q16539 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 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
SCHEMBL1807472 0.86 MYC (0.39) MYCTTRCYP1A2PDCD1CD274
SCHEMBL15988187 0.86 MGLL (0.39) MYCTTRCYP1A2
SCHEMBL1806998 0.85 PDCD1 (0.47) MYCTTRCYP1A2PDCD1CD274
SCHEMBL1806647 0.84 CA2 (0.41) CDK2CA12CA1CA2CA4
SCHEMBL15541484 0.84 MYC (0.38) MYCTTRCYP1A2SNCAGABRA1
SCHEMBL3367748 0.83 GABRA1 (0.45) MYCTTRCYP1A2SNCAGABRA1
SCHEMBL1806994 0.81 MYC (0.41) MYCTTRCYP1A2PDCD1CD274
SCHEMBL1807545 0.81 MYC (0.43) MYCTTRCYP1A2FABP4CCNA2
SCHEMBL1804584 0.80 MYC (0.40) MYCTTRCYP1A2PDCD1CD274
SCHEMBL5075686 0.80 TTR (0.38) MYCTTRCYP1A2FABP4CCNA2

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 MYC 3750/4885TTR 594/4885CYP1A2 487/4885

“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.