SCHEMBL4978263

SCHEMBL4978263

O=C(O)CCCCCC1CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 4/20 0.65
PHF8 Q9UPP1 4/20 0.65
KDM2A Q9Y2K7 4/20 0.65
KDM4C Q9H3R0 3/20 0.65
KDM7A Q6ZMT4 1/20 0.65
LMNA P02545 3/20 0.57
TSHR P16473 3/20 0.57
PMP22 Q01453 2/20 0.57
NFKB1 P19838 1/20 0.57
KDM4A O75164 1/20 0.54
HSD17B10 Q99714 2/20 0.50
ALDH1A1 P00352 2/20 0.50
CYP2C9 P11712 1/20 0.50
MEN1 O00255 1/20 0.50
NR1I2 O75469 1/20 0.50
POLB P06746 1/20 0.50
THRB P10828 1/20 0.50
ACHE P22303 1/20 0.50
APEX1 P27695 1/20 0.50
RECQL P46063 1/20 0.50

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
SCHEMBL31454264 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL11848931 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL1456488 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL1457469 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL4449247 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL11851432 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL16046794 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL826408 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL11849540 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL28448757 1.00 KDM5A (0.65) KDM5APHF8KDM2AKDM4CKDM7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541362-B2 Cyclopropyl compounds and compositions for delivering active agents EMISPHERE TECHNOLOGIES, INC. (US) 2013-09-24 US disclosed
US-8541362-B2 Cyclopropyl compounds and compositions for delivering active agents EMISPHERE TECHNOLOGIES, INC. (US) 2013-09-24 US disclosed
WO-2013116126-A1 NOVEL LOW MOLECULAR WEIGHT, BIODEGRADABLE CATIONIC LIPIDS FOR OLIGONUCLEOTIDE DELIVERY MERCK SHARP & DOHME CORP. (US) 2013-08-08 WO disclosed
US-20090220451-A1 CYCLOPROPYL COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2009-09-03 US disclosed
US-20090220451-A1 CYCLOPROPYL COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2009-09-03 US disclosed
US-7339065-B2 Design and synthesis of optimized ligands for PPAR BETHESDA PHARMACEUTICALS, INC. (US) 2008-03-04 US disclosed
US-20070099969-A1 Design and synthesis of optimized ligands for ppar THE UNIVERSITY OF MISSISSIPPI 2007-05-03 US disclosed
WO-2007022532-A2 CYCLOPROPYL COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2007-02-22 WO disclosed
WO-2002076177-A2 DESIGN AND SYNTHESIS OF OPTIMIZED LIGANDS FOR PPAR BETHESDA PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed
US-3993773-A Control of mites with esters of cyclopropane substituted carboxylic acids ZOECON CORPORATION (US) 1976-11-23 US disclosed
US-3960907-A MITICIDES ZOECON CORPORATION (US) 1976-06-01 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-20090220451-A1 CYCLOPROPYL COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS PAICS, ABCB4, ABCB11 KDM5A 4407/4885PHF8 4057/4885KDM2A 4542/4885
US-20070099969-A1 Design and synthesis of optimized ligands for ppar PPARD, PPARA, PPARG KDM5A 172/4885PHF8 1250/4885KDM2A 679/4885

“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.