SCHEMBL5648489

SCHEMBL5648489

O=C(ON1C(=O)CCC1=O)c1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.47
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
CA7 P43166 4/20 0.47
CA9 Q16790 4/20 0.47
CA14 Q9ULX7 4/20 0.47
ESR1 P03372 5/20 0.43
KMT2A Q03164 3/20 0.43
ESR2 Q92731 3/20 0.43
MEN1 O00255 2/20 0.43
RAB9A P51151 1/20 0.41
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CHRM1 P11229 1/20 0.41
SLC6A2 P23975 1/20 0.41
KDR P35968 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 3/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL14979300 0.95 LMNA (0.45) CA12CA1CA2CA7CA9
SCHEMBL300884 0.92 CA12 (0.42) CA12CA1CA2CA7CA9
SCHEMBL31225538 0.92 PARP10 (0.49) CA12CA1CA2CA7CA9
SCHEMBL22046417 0.91 F3 (0.44) CA12CA1CA2CA7CA9
SCHEMBL13455758 0.87 SMN1; SMN2 (0.44) CA12CA1CA2CA9CA14
SCHEMBL22046616 0.87 HDAC6 (0.41) CA12CA1CA2CA7CA9
SCHEMBL27717830 0.85 CA1 (0.55) CA12CA1CA2CA7CA9
SCHEMBL9551376 0.84 KMT2A (0.44) ESR1KMT2AESR2MEN1RAB9A
SCHEMBL317627 0.84 PTPN2 (0.44) CA12CA1CA2CA9KMT2A
SCHEMBL159204 0.84 KDM4E (0.42) CA1CA2KMT2AMEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114423781-B Electrical conductors and methods for conducting ions with troponin 北京大学 2024-03-26 CN disclosed
US-8945927-B2 Polymers for delivering molecules of interest UNIVERSITE DE STRASBOURG (FR) 2015-02-03 US disclosed
US-8945927-B2 Polymers for delivering molecules of interest UNIVERSITE DE STRASBOURG (FR) 2015-02-03 US disclosed
EP-1807436-B1 HETEROBIFUNCTIONAL POLY(ETHYLENE GLYCOL) AND USES THEREOF INTEZYNE TECHNOLOGIES INC (US) 2014-06-18 EP disclosed
WO-2013106097-A1 POLY(ETHYLENE GLYCOL) DERIVATIVES FOR CLICK CHEMISTRY INTEZYNE TECHNOLOGIES, INC. (US) 2013-07-18 WO disclosed
US-20130178600-A1 POLY(ETHYLENE GLYCOL) DERIVATIVES FOR CLICK CHEMISTRY INTEZYNE TECHNOLOGIES, INC. (US) 2013-07-11 US disclosed
US-20130178600-A1 POLY(ETHYLENE GLYCOL) DERIVATIVES FOR CLICK CHEMISTRY INTEZYNE TECHNOLOGIES, INC. (US) 2013-07-11 US disclosed
US-20130096177-A1 POLYMERS FOR DELIVERING MOLECULES OF INTEREST CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-04-18 US disclosed
US-20130096177-A1 POLYMERS FOR DELIVERING MOLECULES OF INTEREST CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-04-18 US disclosed
EP-2502941-A1 Heterobifunctional poly (ethylene glycol) and uses thereof Intezyne Technologies Inc. (US) 2012-09-26 EP disclosed
US-20030166644-A1 Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK A/S (DK) 2003-09-04 US disclosed
WO-2003051841-A2 COMPOUNDS AND USES THEREOF FOR DECREASING ACTIVITY OF HORMONE-SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2003-06-26 WO disclosed
WO-2003051842-A2 COMPOSITIONS DECREASING ACTIVITY OF HORMONE-SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2003-06-26 WO disclosed
EP-0244836-B1 TRIPEPTIDE DERIVATIVES Dainippon Pharmaceutical Co., Ltd. (JP) 1993-08-18 EP disclosed
US-4826814-A INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1989-05-02 US disclosed
EP-0170415-B1 PHENANTHRIDINIUM ESTER AS A LABELLING COMPOUND IN LUMINOMETRIC IMMUNOASSAY Mallinckrodt, Inc. (a Delaware corporation) (US) 1988-04-20 EP disclosed
EP-0244836-A2 Tripeptide derivatives Dainippon Pharmaceutical Co., Ltd. (JP) 1987-11-11 EP disclosed
US-4687747-A Phenanthridinium ester as a labelling compound in luminometric immunoassay MALLINCKRODT, INC. (US) 1987-08-18 US disclosed
EP-0170415-A1 Phenanthridinium ester as a labelling compound in luminometric immunoassay Mallinckrodt, Inc. (a Delaware corporation) (US) 1986-02-05 EP disclosed
US-4112219-A Acyl derivatives of antibiotic BM123γ AMERICAN CYANAMID COMPANY (US) 1978-09-05 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 (2 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-20130096177-A1 POLYMERS FOR DELIVERING MOLECULES OF INTEREST PHAX, CD44, SNRPE CA12 1261/4885CA1 2174/4885CA2 1895/4885
US-20030166644-A1 Compounds and uses thereof for decreasing activity of hormone-sensitive lipase LIPE, PNLIP, LPL CA12 3885/4885CA1 3261/4885CA2 3744/4885

“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.