SCHEMBL6937576

SCHEMBL6937576

CC(C)(C)OC(=O)N1CCC(OC(=O)OC2CCN(C(=O)OC(C)(C)C)CC2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.56
HPGD P15428 1/20 0.55
RECQL P46063 1/20 0.53
USP2 O75604 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PTPN2 P17706 1/20 0.51
PTPN1 P18031 1/20 0.51
PTPN6 P29350 1/20 0.51
ALDH1A1 P00352 2/20 0.49
GPR119 Q8TDV5 5/20 0.49
MAPT P10636 2/20 0.48
NPC1 O15118 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KDM4E B2RXH2 2/20 0.48
THRB P10828 1/20 0.48
PKM P14618 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL1024755 0.88 HPGD (0.54) EPHX1HPGDRECQLUSP2SMN1; SMN2
SCHEMBL2566080 0.88 HPGD (0.54) EPHX1HPGDRECQLUSP2SMN1; SMN2
SCHEMBL9231251 0.88 HPGD (0.48) EPHX1HPGDRECQLUSP2SMN1; SMN2
SCHEMBL25067967 0.86 HPGD (0.53) EPHX1HPGDRECQLUSP2SMN1; SMN2
SCHEMBL9834472 0.86 HPGD (0.53) EPHX1HPGDRECQLUSP2SMN1; SMN2
SCHEMBL2217468 0.86 HPGD (0.53) EPHX1HPGDRECQLUSP2SMN1; SMN2
SCHEMBL27592801 0.86 HPGD (0.47) EPHX1HPGDRECQLUSP2SMN1; SMN2
SCHEMBL6935422 0.86 HPGD (0.47) EPHX1HPGDRECQLUSP2SMN1; SMN2
SCHEMBL7051016 0.86 EPHX1 (0.45) EPHX1HPGDRECQLPTPN2PTPN1
SCHEMBL23225698 0.85 HPGD (0.46) EPHX1HPGDRECQLUSP2SMN1; SMN2

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
EP-2894149-B1 Cyanoguanidine prodrugs LEO PHARMA AS (DK) 2017-08-02 EP disclosed
EP-1339686-B1 CYANOGUANIDINE PRODRUGS LEO PHARMA AS (DK) 2015-09-16 EP disclosed
EP-2894149-A1 Cyanoguanidine prodrugs LEO PHARMA A/S (DK) 2015-07-15 EP disclosed
EP-1339686-A2 CYANOGUANIDINE PRODRUGS Leo Pharma A/S (DK) 2003-09-03 EP disclosed
US-6525077-B2 Antiproliferative agents LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2003-02-25 US disclosed
US-20020165201-A1 Cyanoguanidine prodrugs LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 2002-11-07 US disclosed
WO-2002042265-A2 CYANOGUANIDINE PRODRUGS LEO PHARMA A/S (DK) 2002-05-30 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 (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-20020165201-A1 Cyanoguanidine prodrugs CBR1, SIGMAR1, ROR1 EPHX1 915/4885HPGD 958/4885RECQL 3407/4885

“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.