SCHEMBL7939273

SCHEMBL7939273

CC([O])CCCOO

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL7937168 0.92
Bicarbonate SCHEMBL28380983 0.80 BLM (0.43)
SCHEMBL11472453 0.78
SCHEMBL27459290 0.76
SCHEMBL8058225 0.75
Bicarbonate SCHEMBL10703410 0.75
Bicarbonate SCHEMBL10890665 0.73 BLM (0.38)
SCHEMBL14691431 0.72 ZDHHC7 (0.33)
Bicarbonate SCHEMBL10890822 0.71 ACE2 (0.38)
SCHEMBL15158161 0.70 ACACB (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2828260-A1 PROCESS FOR THE PREPARATION OF TETRACARBOXYNAPHTHALENEDIIMIDE COMPOUNDS DISUBSTITUTED WITH HETEROARYL GROUPS ENI S.p.A. (IT) 2015-01-28 EP disclosed
EP-2742041-A1 PROCESS FOR THE PREPARATION OF BENZOHETERO [ 1, 3]- DIAZOLE COMPOUNDS DISUBSTITUTED WITH HETEOARYL GROUPS ENI S.p.A. (IT) 2014-06-18 EP disclosed
WO-2013140328-A1 PROCESS FOR THE PREPARATION OF TETRACARBOXYNAPHTHALENEDIIMIDE COMPOUNDS DISUBSTITUTED WITH HETEROARYL GROUPS ENI S.P.A. (IT) 2013-09-26 WO disclosed
WO-2013021315-A1 PROCESS FOR THE PREPARATION OF BENZOHETERO [ 1, 3 ] - DIAZOLE COMPOUNDS DISUBSTITUTED WITH HETEOARYL GROUPS ENI S.P.A. (IT) 2013-02-14 WO disclosed
CN-102574824-A Desferrithiocin polyether analogues and uses thereof DESFERRITHIOCIN POLYETHER ANALOGUES AND USES THEREOF 2012-07-11 CN disclosed
EP-1082610-A1 METHOD FOR MARKING LIQUIDS WITH AT LEAST TWO MARKER SUBSTANCES AND METHOD FOR DETECTING THEM BASF AKTIENGESELLSCHAFT (DE) 2001-03-14 EP disclosed
EP-1013660-A1 2-FLUOROFUCOSYL-N-AROYLGLUCOSAMINE DERIVATIVES, INTERMEDIATES THEREFOR, AND PROCESSES FOR PRODUCING THESE Daikin Industries, Limited (JP) 2000-06-28 EP disclosed
WO-1999056125-A1 METHOD FOR MARKING LIQUIDS WITH AT LEAST TWO MARKER SUBSTANCES AND METHOD FOR DETECTING THEM BASF AKTIENGESELLSCHAFT (DE) 1999-11-04 WO disclosed