SCHEMBL8240579

SCHEMBL8240579

CCCCCNC(=O)CCCCC1SC[C@H]2NC(=O)N[C@@H]12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.72
▸ HLCS P50747 2/20 0.70
▸ CNR1 P21554 2/20 0.63
▸ MEN1 O00255 1/20 0.62
▸ ABL1 P00519 1/20 0.62
▸ LMNA P02545 1/20 0.62
▸ PKM P14618 1/20 0.62
▸ IDE P14735 1/20 0.62
▸ MAPK1 P28482 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ RIN1 Q13671 1/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.62
▸ CNR2 P34972 2/20 0.61
▸ CA12 O43570 2/20 0.61
▸ CA1 P00915 2/20 0.61
▸ CA2 P00918 2/20 0.61
▸ CA9 Q16790 2/20 0.61
▸ F2 P00734 1/20 0.60
▸ PRSS1 P07477 1/20 0.60
▸ PRSS2 P07478 1/20 0.60

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
SCHEMBL17704089 1.00 TDP1 (0.72) TDP1HLCSCNR1MEN1ABL1
SCHEMBL6941477 1.00 TDP1 (0.72) TDP1HLCSCNR1MEN1ABL1
SCHEMBL13045403 0.99 HLCS (0.71) TDP1HLCSCNR1MEN1ABL1
SCHEMBL15870672 0.99 HLCS (0.71) TDP1HLCSCNR1MEN1ABL1
SCHEMBL22493325 0.99 HLCS (0.71) TDP1HLCSCNR1MEN1ABL1
SCHEMBL12320610 0.99 HLCS (0.71) TDP1HLCSCNR1MEN1ABL1
SCHEMBL7376597 0.99 HLCS (0.71) TDP1HLCSCNR1MEN1ABL1
SCHEMBL12729936 0.99 HLCS (0.71) TDP1HLCSCNR1MEN1ABL1
SCHEMBL13621820 0.97 TDP1 (0.70) TDP1HLCSCNR1MEN1ABL1
SCHEMBL14600797 0.97 TDP1 (0.70) TDP1HLCSCNR1MEN1ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120129767-A1 USE OF A GHRELIN AGONIST TO IMPROVE THE CATABOLIC EFFECTS OF GLUCOCORTICOID TREATMENT BIOMEASURE, INCORPORATED 2012-05-24 — — US disclosed
US-20110166069-A1 COMPOSITIONS AND METHODS FOR STIMULATING GASTROINTESTINAL MOTILITY BIOMEASURE, INCORPORATED 2011-07-07 — — US disclosed
US-20110160133-A1 METHOD FOR INHIBITING INFLAMMATION AND PRE-INFLAMMATORY CYTOKINE/CHEMOKINE EXPRESSION USING A GHRELIN ANALOGUE IPSEN PHARMA S.A.S. (FR) 2011-06-30 — — US disclosed
US-20100227806-A1 Use Of A Ghrelin Agonist To Improve Catabolic Effects Of Glucocorticoid Treatment BIOMEASURE, INCORPORATED 2010-09-09 — — US disclosed
US-20090163416-A1 Use of a ghrelin agonist to improve the catabolic effects of glucocorticoid treatment IPSEN PHARMA S.A.S. (FR) 2009-06-25 — — US disclosed
WO-2009020643-A2 METHOD FOR INHIBITING INFLAMMATION AND PRE-INFLAMMATORY CYTOKINE/CHEMOKINE EXPRESSION USING A GHRELIN ANALOGUE IPSEN PHARMA S.A.S. (FR) 2009-02-12 — — WO disclosed
WO-2007041278-A2 COMPOSITION AND METHODS FOR STIMULATING GASTROINTESTINAL MOTILITY SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES S.A.S. (FR) 2007-04-12 — — 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 (5 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-20100227806-A1 Use Of A Ghrelin Agonist To Improve Catabolic Effects Of Glucocorticoid Treatment GHSR, GHRHR, NR3C1 TDP1 4739/4885HLCS 3793/4885CNR1 1340/4885
US-20090163416-A1 Use of a ghrelin agonist to improve the catabolic effects of glucocorticoid treatment GHSR, GHRHR, NR3C1 TDP1 4219/4885HLCS 4091/4885CNR1 1656/4885
US-20110160133-A1 METHOD FOR INHIBITING INFLAMMATION AND PRE-INFLAMMATORY CYTOKINE/CHEMOKINE EXPRESSION USING A GHRELIN ANALOGUE PROKR1, PROKR2, CCL2 TDP1 4705/4885HLCS 2627/4885CNR1 820/4885
US-20110166069-A1 COMPOSITIONS AND METHODS FOR STIMULATING GASTROINTESTINAL MOTILITY GIPR, VIP, GRPR TDP1 4078/4885HLCS 1488/4885CNR1 1858/4885
US-20120129767-A1 USE OF A GHRELIN AGONIST TO IMPROVE THE CATABOLIC EFFECTS OF GLUCOCORTICOID TREATMENT GHSR, GHRHR, NR3C1 TDP1 4292/4885HLCS 4070/4885CNR1 1705/4885

“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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