SCHEMBL6187331

SCHEMBL6187331

CCOC(=O)C1(CCO)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46
MEN1 O00255 11/20 0.41
KMT2A Q03164 11/20 0.41
ALDH1A1 P00352 7/20 0.41
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 2/20 0.40
MAPK1 P28482 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 2/20 0.39

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
SCHEMBL2795230 0.92 CYP4F2 (0.53) CYP4F2CYP4A11MEN1KMT2AALDH1A1
SCHEMBL415499 0.90 MEN1 (0.42) CYP4F2CYP4A11MEN1KMT2AALDH1A1
SCHEMBL7309006 0.89 USP2 (0.43) CYP4F2CYP4A11MEN1KMT2AALDH1A1
SCHEMBL7443750 0.88 CYP4F2 (0.45) CYP4F2CYP4A11MEN1KMT2AALDH1A1
SCHEMBL1440150 0.88 MEN1 (0.41) CYP4F2CYP4A11MEN1KMT2AALDH1A1
SCHEMBL6186611 0.88 MEN1 (0.41) CYP4F2CYP4A11MEN1KMT2AALDH1A1
SCHEMBL963907 0.87 USP2 (0.47) CYP4F2CYP4A11MEN1KMT2AALDH1A1
SCHEMBL336548 0.87 MAPK1 (0.54) MEN1KMT2AALDH1A1MAPK1MAPT
SCHEMBL394272 0.86 MAPK1 (0.40) CYP4F2CYP4A11MEN1KMT2AALDH1A1
SCHEMBL14522047 0.86 MEN1 (0.39) CYP4F2CYP4A11MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1070714-A9 AMIDINE COMPOUNDS JAPAN TOBACCO INC. (JP) 2005-10-19 EP disclosed
EP-1070714-B1 AMIDINE COMPOUNDS JAPAN TOBACCO INC (JP) 2004-08-04 EP disclosed
US-20040006099-A1 Amidine compounds JAPAN TOBACCO INC. 2004-01-08 US disclosed
US-6562828-B1 Novel amidine compound having a blood coagulation factor Xa inhibitory activity JAPAN TOBACCO INC. (JP) 2003-05-13 US disclosed
EP-1070714-A1 AMIDINE COMPOUNDS JAPAN TOBACCO INC. (JP) 2001-01-24 EP 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-20040006099-A1 Amidine compounds F2, SERPINC1, F12 CYP4F2 416/4885CYP4A11 427/4885MEN1 360/4885

“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.