SCHEMBL7873518

SCHEMBL7873518

O=S(=O)(O)c1nc2c(ccc3c(-c4ccccc4)ccnc32)c(-c2ccccc2)c1S(=O)(=O)O.[NaH].[NaH]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 3/20 0.39
CKS1B P61024 7/20 0.37
SKP2 Q13309 7/20 0.37
GLO1 Q04760 2/20 0.37
MMP2 P08253 2/20 0.35
ALDH1A1 P00352 1/20 0.35
NR1H2 P55055 4/20 0.33
NR1H3 Q13133 4/20 0.33
IKBKB O14920 1/20 0.33
CHUK O15111 1/20 0.33
DAPK3 O43293 1/20 0.33
JAK2 O60674 1/20 0.33
PRKD3 O94806 1/20 0.33
MAP4K4 O95819 1/20 0.33
PAK4 O96013 1/20 0.33
CSF1R P07333 1/20 0.33
RET P07949 1/20 0.33
IGF1R P08069 1/20 0.33
FGFR1 P11362 1/20 0.33
PRKACA P17612 1/20 0.33

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
SCHEMBL29026621 0.99 TOP2A (0.38) TOP2ACKS1BSKP2GLO1MMP2
Water SCHEMBL8819292 0.99 TOP2A (0.38) TOP2ACKS1BSKP2GLO1MMP2
SCHEMBL597833 0.99 TOP2A (0.40) TOP2ACKS1BSKP2GLO1MMP2
SCHEMBL870765 0.99 TOP2A (0.40) TOP2ACKS1BSKP2GLO1MMP2
SCHEMBL6037850 0.98 TOP2A (0.39) TOP2ACKS1BSKP2GLO1MMP2
SCHEMBL27805381 0.98 TOP2A (0.39) TOP2ACKS1BSKP2GLO1MMP2
SCHEMBL15570898 0.93 TOP2A (0.36) TOP2ACKS1BSKP2GLO1MMP2
SCHEMBL4892330 0.91 TOP2A (0.38) TOP2ACKS1BSKP2GLO1MMP2
SCHEMBL3964610 0.82 CKS1B (0.36) TOP2ACKS1BSKP2GLO1MMP2
SCHEMBL8140844 0.82 CKS1B (0.38) TOP2ACKS1BSKP2GLO1MMP2

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3216788-A1 ALPHA-HYDROXY-BETA-TRIAZOLO-TETRAZOLES Centre National De La Recherche Scientifique (FR) 2017-09-13 EP claimed
EP-0170414-B1 PROCESS FOR TREATING METAL SURFACE Hitachi Chemical Co., Ltd. (JP) 1991-04-17 EP claimed
US-4643793-A WITH MIXTURE OF COPPER COMPOUND, COMPLEXING AGENT, REDUCING AGENT, AND PH ADJUSTER IN PRESENCE OF NITROGEN HETEROCYCLE COMPOUND HITACHI CHEMICAL COMPANY, LTD. (JP) 1987-02-17 US claimed
EP-0170414-A2 Process for treating metal surface Hitachi Chemical Co., Ltd. (JP) 1986-02-05 EP claimed
US-10259838-B2 Methods, compositions, and kits using heterogeneous catalysts OCCIDENTAL COLLEGE (US) 2019-04-16 US disclosed
US-9879044-B2 Methods, compositions, and kits using heterogeneous catalysts OCCIDENTAL COLLEGE (US) 2018-01-30 US disclosed
US-20170327532-A1 METHODS, COMPOSITIONS, AND KITS USING HETEROGENEOUS CATALYSTS OCCIDENTAL COLLEGE 2017-11-16 US disclosed
US-9765064-B1 Alpha-hydroxy-beta-azido-tetrazoles CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-09-19 US disclosed
US-20170260171-A1 ALPHA-HYDROXY-BETA-AZIDO-TETRAZOLES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-09-14 US disclosed
EP-3216788-A1 ALPHA-HYDROXY-BETA-TRIAZOLO-TETRAZOLES Centre National De La Recherche Scientifique (FR) 2017-09-13 EP disclosed
US-20160347785-A1 METHODS, COMPOSITIONS, AND KITS USING HETEROGENEOUS CATALYSTS OCCIDENTAL COLLEGE 2016-12-01 US disclosed
CN-106028840-A Mineral water composition containing bioavailable iron 史诺多尼亚研究有限公司 2016-10-12 CN disclosed
WO-1999040424-A1 WATER SOLUBLE LUMINESCENCE OXYGEN SENSOR AND METHOD LAKOWICZ JOSEPH R (US) 1999-08-12 WO disclosed
EP-0296686-B1 A PROCESS FOR THE PREPARATION OF CARBAMATES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-04-01 EP disclosed
EP-0170414-B1 PROCESS FOR TREATING METAL SURFACE Hitachi Chemical Co., Ltd. (JP) 1991-04-17 EP disclosed
EP-0296686-A1 A process for the preparation of carbamates SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-12-28 EP disclosed
US-4643793-A WITH MIXTURE OF COPPER COMPOUND, COMPLEXING AGENT, REDUCING AGENT, AND PH ADJUSTER IN PRESENCE OF NITROGEN HETEROCYCLE COMPOUND HITACHI CHEMICAL COMPANY, LTD. (JP) 1987-02-17 US disclosed
EP-0170414-A2 Process for treating metal surface Hitachi Chemical Co., Ltd. (JP) 1986-02-05 EP disclosed
EP-0061079-B1 POLYMER STABILIZERS GAF CORPORATION (US) 1985-07-31 EP disclosed
US-4396734-A VINYL POLYMER THICKENER, REDOX INDICATOR, MUCILAGE GAF CORPORATION (US) 1983-08-02 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-20170260171-A1 ALPHA-HYDROXY-BETA-AZIDO-TETRAZOLES CYP8B1, HSD3B1, HSD17B1 TOP2A 871/4885CKS1B 3449/4885SKP2 1363/4885

“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.