SCHEMBL1807002

SCHEMBL1807002

NS(=O)(=O)c1cccc2cc(C(=O)O)c([O])cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
HSD17B10 Q99714 3/20 0.50
CASP1 P29466 2/20 0.50
CASP7 P55210 2/20 0.50
USP2 O75604 2/20 0.50
POLB P06746 2/20 0.50
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
CA9 Q16790 3/20 0.49
GRIN2D O15399 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
ALDH1A1 P00352 3/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP1A2 P05177 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL1805839 0.89 CA2 (0.50) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL1805366 0.88 CYP2D6 (0.51) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL1807003 0.86 GRIN2D (0.66) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL1805841 0.80 KDM4E (0.51) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL1808029 0.79 PTPN1 (0.47) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL1806297 0.78 KDM4E (0.47) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL165075 0.76 CYP2D6 (0.55) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL29450072 0.76 CYP2D6 (0.55) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL1805368 0.75 GRIN2D (0.68) KDM4EMEN1KMT2AHSD17B10CASP1
SCHEMBL1808030 0.74 HSD17B10 (0.51) KDM4EMEN1KMT2AHSD17B10CASP1

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 KDM4E 1406/4885MEN1 592/4885KMT2A 1224/4885

“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.