SCHEMBL6134736

SCHEMBL6134736

CCCC(OC)OCC1CCN(C(=O)O)CC1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SLC1A3 P43003 6/20 0.33
SLC1A2 P43004 6/20 0.33
SLC1A1 P43005 6/20 0.33
ITGB3 P05106 1/20 0.32
ITGA2B P08514 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
RBP4 P02753 1/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RAB9A P51151 2/20 0.31
NPC1 O15118 1/20 0.30

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
SCHEMBL6133897 0.78 MAPK1 (0.32) MAPK1SMN1; SMN2DPP8DPP7
SCHEMBL797393 0.74 KMT2A (0.42) RAB9ANPC1
SCHEMBL19874766 0.71 DPP8 (0.35) SLC1A3SLC1A2SLC1A1DPP8DPP7
SCHEMBL3315020 0.70
SCHEMBL2773399 0.70 RAB9A (0.40) RBP4RAB9ANPC1
SCHEMBL15390149 0.70 RAB9A (0.40) RBP4RAB9ANPC1
SCHEMBL12016032 0.69 GNAI3 (0.45) ITGB3ITGA2B
SCHEMBL796623 0.69 ALDH1A1 (0.36) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B
SCHEMBL155583 0.69 EPHX2 (0.41) DPP8DPP7ALDH1A1L3MBTL1NPC1
SCHEMBL3160989 0.68 TACR3 (0.36) SLC1A3SLC1A2SLC1A1ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 US disclosed
EP-1366066-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-03 EP disclosed
WO-2002072621-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-19 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 MAPK1 251/4885SMN1; SMN2 3682/4885SLC1A3 3489/4885

“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.