SCHEMBL12282003

SCHEMBL12282003

CNCCCCCCNC(C)=O

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.80
MAPK1 P28482 1/20 0.80
HIF1A Q16665 1/20 0.80
PAOX Q6QHF9 3/20 0.64
ADRA1A P35348 1/20 0.61
TSHR P16473 1/20 0.46
EPHX1 P07099 6/20 0.46
ALDH1A1 P00352 2/20 0.44
NAMPT P43490 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL22197991 1.00 KDM4E (0.80) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL24508761 1.00 KDM4E (0.80) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL12445967 1.00 KDM4E (0.80) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL12281920 1.00 KDM4E (0.80) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL12070762 0.97 KDM4E (0.75) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL12014973 0.93 KDM4E (0.70) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL2952645 0.92
SCHEMBL14739904 0.89 KDM4E (1.00) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL14740196 0.89 KDM4E (1.00) KDM4EMAPK1HIF1APAOXADRA1A
SCHEMBL1900654 0.89 KDM4E (1.00) KDM4EMAPK1HIF1APAOXADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022103834-A1 COMBINATIONS OF METAP2 INHIBITORS AND CDK4/6 INHIBITORS FOR THE TREATMENT OF CANCER SYNDEVRX, INC. (US) 2022-05-19 WO disclosed
WO-2020035049-A1 DEGRADATION AGENTS FOR CYCLIN DEPENDENT KINASE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF 中国科学院上海药物研究所 2020-02-20 WO disclosed
US-20160346236-A1 COMPOSITIONS AND METHODS FOR MODULATING HEXM1 EXPRESSION CLEVELAND STATE UNIVERSITY 2016-12-01 US disclosed
US-8716293-B2 Macrocyclic integrase inhibitors JANSSEN R&D IRELAND (IE) 2014-05-06 US disclosed
US-8716293-B2 Macrocyclic integrase inhibitors JANSSEN R&D IRELAND (IE) 2014-05-06 US disclosed
EP-2552923-B1 MACROCYCLIC INTEGRASE INHIBITORS JANSSEN R & D IRELAND (IE) 2014-03-26 EP disclosed
US-20130035341-A1 MACROCYCLIC INTEGRASE INHIBITORS JANSSEN R&D IRELAND (IE) 2013-02-07 US disclosed
US-20130035341-A1 MACROCYCLIC INTEGRASE INHIBITORS JANSSEN R&D IRELAND (IE) 2013-02-07 US disclosed
WO-2011121105-A1 MACROCYCLIC INTEGRASE INHIBITORS TIBOTEC PHARMACEUTICALS (IE) 2011-10-06 WO disclosed
US-7968134-B2 Films comprising a liquid-absorbant inner layer and an impermeable outer layer E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-28 US disclosed
US-7964226-B2 Films comprising a liquid-absorbant inner layer and an impermeable outer layer E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-21 US disclosed
US-7964055-B2 Films comprising a liquid-absorbant inner layer and an impermeable outer layer E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-21 US disclosed
US-7964229-B2 Films comprising a liquid-absorbant inner layer and an impermeable outer layer E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-21 US disclosed
US-20100166925-A1 FILMS COMPRISING A LIQUID-ABSORBANT INNER LAYER AND AN IMPERMEABLE OUTER LAYER E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-01 US disclosed
US-20100009041-A1 FILMS COMPRISING A LIQUID-ABSORBANT INNER LAYER AND AN IMPERMEABLE OUTER LAYER E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-01-14 US disclosed
US-20100009046-A1 FILMS COMPRISING A LIQUID-ABSORBANT INNER LAYER AND AN IMPERMEABLE OUTER LAYER E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-01-14 US disclosed
US-20100009045-A1 FILMS COMPRISING A LIQUID-ABSORBANT INNER LAYER AND AN IMPERMEABLE OUTER LAYER E.I.DU PONT DE NEMOURS AND COMPANY (US) 2010-01-14 US disclosed
US-7615270-B2 Multilayer tubal casings; interior layer of polyamideether or polyesterether block copolymer; exterior of polyamides, ethylene-vinyl alcohol copolymer, polyvinylidene chloride, polyolefin E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-11-10 US disclosed
US-7381788-B2 Method for continuous production of polyamide TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-06-03 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-20130035341-A1 MACROCYCLIC INTEGRASE INHIBITORS TYMP, PIM1, TYMS KDM4E 911/4885MAPK1 2190/4885HIF1A 4460/4885
US-20160346236-A1 COMPOSITIONS AND METHODS FOR MODULATING HEXM1 EXPRESSION HEXB, HEXA, MYADM KDM4E 3239/4885MAPK1 788/4885HIF1A 173/4885

“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.