SCHEMBL1807472

SCHEMBL1807472

Cc1c(CC[O])cccc1S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.39
TTR P02766 2/20 0.37
CYP1A2 P05177 1/20 0.35
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
NR4A1 P22736 1/20 0.30
CTSB P07858 1/20 0.30
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 1/20 0.30

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
SCHEMBL1807475 0.86 MYC (0.39) MYCTTRCYP1A2SNCAGABRA1
SCHEMBL15988187 0.86 MGLL (0.39) MYCTTRCYP1A2
SCHEMBL1806994 0.85 MYC (0.41) MYCTTRCYP1A2SNCAGABRA1
SCHEMBL15541484 0.84 MYC (0.38) MYCTTRCYP1A2SNCAGABRA1
SCHEMBL3367748 0.83 GABRA1 (0.45) MYCTTRCYP1A2SNCAGABRA1
SCHEMBL1806645 0.82 CA2 (0.39) CDK2
SCHEMBL1806998 0.81 PDCD1 (0.47) MYCTTRCYP1A2SNCAGABRA1
SCHEMBL1807544 0.81 MYC (0.43) MYCTTRCYP1A2SNCAFABP4
SCHEMBL1804588 0.80 CYP1A2 (0.42) MYCTTRCYP1A2SNCAGABRA1
SCHEMBL1804584 0.80 MYC (0.40) MYCTTRCYP1A2SNCAGABRA1

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.