SCHEMBL2384183

SCHEMBL2384183

Nc1c(-c2cc3ccccc3[nH]2)cccc1S(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 3/20 0.48
▸ CHEK1 O14757 1/20 0.48
▸ CA2 P00918 2/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ MAPT P10636 3/20 0.44
▸ HPGD P15428 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ AURKA O14965 1/20 0.44
▸ EDNRB P24530 1/20 0.44
▸ EDNRA P25101 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ USP2 O75604 1/20 0.43

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
SCHEMBL9818427 0.87 KDR (0.54) KDRCHEK1CA2CA12CA1
SCHEMBL3138805 0.77 KDR (0.53) KDRCHEK1CA2CA12CA1
2-(2'-Hydroxyphenyl)-1H-Indole SCHEMBL22418991 0.75 KDM4E (0.59) KDRCHEK1CA2CA12CA1
SCHEMBL5051826 0.73 KDR (0.68) KDRCHEK1CA2CA12CA1
SCHEMBL4009389 0.72 CDC7 (0.44) KDRAURKAGSK3B
SCHEMBL221259 0.72 KDR (0.58) KDRCHEK1CA2CA12CA1
SCHEMBL29361867 0.72 KDR (0.58) KDRCHEK1CA2CA12CA1
SCHEMBL11871951 0.71 KDR (0.50) KDRCHEK1CA2CA12CA1
SCHEMBL10176240 0.71 KDR (0.61) KDRCHEK1MEN1KMT2AKDM4E
Methane SCHEMBL28704887 0.71 KDR (0.66) KDRCHEK1CA2CA12CA1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017769-B2 Colorless water-soluble organic luminophores and intermediates thereof Nyrt, Allami Nyomda (HU) 2011-09-13 — — US disclosed
US-20080312436-A1 Colorless Water-Soluble Organic Luminophores and Intermediates Thereof ANY BIZTONSÀGI NYOMDA NYILVÀNOSAN MUKÖDO RÉSZVÉNYTÀRSASÀG (HU) 2008-12-18 — — US disclosed
EP-1910351-B1 COLOURLESS WATER-SOLUBLE ORGANIC LUMINOPHORES AND INTERMEDIATES THEREOF ALLAMI NYOMDA NYRT (HU) 2008-10-22 — — EP disclosed
EP-1910351-A1 COLOURLESS WATER-SOLUBLE ORGANIC LUMINOPHORES AND INTERMEDIATES THEREOF ÁLLAMI NYOMDA NYRT (HU) 2008-04-16 — — EP disclosed
WO-2007012905-A1 COLOURLESS WATER-SOLUBLE ORGANIC LUMINOPHORES AND INTERMEDIATES THEREOF ÁLLAMI NYOMDA NYRT (HU) 2007-02-01 — — WO 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-20080312436-A1 Colorless Water-Soluble Organic Luminophores and Intermediates Thereof IK, XDH, Q6ZSR9 KDR 4045/4885CHEK1 2484/4885CA2 2917/4885

“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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