SCHEMBL5010836

SCHEMBL5010836

CC(=O)OCC1CCCN1C(=O)OCCl

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CHRNB2 P17787 4/20 0.37
CHRNA7 P36544 4/20 0.37
CHRNA4 P43681 4/20 0.37
CHRNA5 P30532 2/20 0.37
KCNK3 O14649 1/20 0.34
PTGS2 P35354 1/20 0.33
CHRM3 P20309 3/20 0.33

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
SCHEMBL5010838 1.00 RAB9A (0.38) RAB9APOLBL3MBTL1CHRNB2CHRNA7
SCHEMBL1665629 0.83 POLB (0.41) RAB9APOLBL3MBTL1CHRNB2CHRNA7
SCHEMBL1665632 0.83 POLB (0.41) RAB9APOLBL3MBTL1CHRNB2CHRNA7
SCHEMBL18710560 0.81 HSD17B10 (0.45) L3MBTL1
SCHEMBL15607552 0.77 ACE2 (0.55) L3MBTL1
SCHEMBL27988461 0.77 PDE8B (0.44)
SCHEMBL28063604 0.76 CHRNB2 (0.38) RAB9APOLBL3MBTL1CHRNB2CHRNA7
SCHEMBL16285121 0.76 BTK (0.39) POLBL3MBTL1CHRNB2CHRNA7CHRNA4
SCHEMBL12986221 0.76 RAB9A (0.43) RAB9APOLBL3MBTL1
SCHEMBL13195867 0.76 RAB9A (0.43) RAB9APOLBL3MBTL1

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-7459561-B2 N-substituted carbamoyloxyalkyl-azolium derivatives BASILEA PHARMACEUTICA AG (CH) 2008-12-02 US disclosed
US-7189858-B2 N-phenyl substituted carbamoyloxyalkyl-azolium derivatives BASILEA PHARMACEUTICA AG (CH) 2007-03-13 US disclosed
US-20070027322-A1 N-substituted carbamoyloxyalkyl-azolium derivatives BASILEA PHARMACEUTICA INTERNATIONAL LTD. (CH) 2007-02-01 US disclosed
US-7151182-B2 Intermediates for N-substituted carbamoyloxyalkyl-azolium derivatives BASILEA PHARMACEUTICA AG (CH) 2006-12-19 US disclosed
US-20050038075-A1 Intermediates for N-substituted carbamoyloxyalkyl-azolium derivatives BASILEA PHARMACEUTICA INTERNATIONAL LTD. (CH) 2005-02-17 US disclosed
US-20050038038-A1 N-phenyl substituted carbamoyloxyalkyl-azolium derivatives BASILEA PHARMACEUTICA INTERNATIONAL LTD. (CH) 2005-02-17 US disclosed
US-6812238-B1 WATER SOLUBLE FUNGICIDES FOR SYSTEMIC MYCOSES; ORAL AND PARENTERAL ADMINISTRATION BASILEA PHARMACEUTICA AG (CH) 2004-11-02 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 (3 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-20070027322-A1 N-substituted carbamoyloxyalkyl-azolium derivatives ERG28, CYP51A1, NAALAD2 RAB9A 1909/4885POLB 4347/4885L3MBTL1 1502/4885
US-20050038038-A1 N-phenyl substituted carbamoyloxyalkyl-azolium derivatives ERG28, CYP51A1, NAALAD2 RAB9A 1876/4885POLB 4340/4885L3MBTL1 1278/4885
US-20050038075-A1 Intermediates for N-substituted carbamoyloxyalkyl-azolium derivatives ERG28, CYP51A1, CPS1 RAB9A 2161/4885POLB 3613/4885L3MBTL1 1888/4885

“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.