SCHEMBL7046532

SCHEMBL7046532

NC(=O)CCC(NC(=O)CCC(=O)O)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 1/20 0.65
FOLH1 Q04609 5/20 0.55
NAALAD2 Q9Y3Q0 3/20 0.55
RIMKLA Q8IXN7 1/20 0.55
KMT2A Q03164 2/20 0.48
NOD1 Q9Y239 3/20 0.46
CA2 P00918 3/20 0.46
CA1 P00915 2/20 0.46
ALOX15 P16050 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44

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
SCHEMBL7047615 0.94 GNPAT (0.56) GNPATFOLH1NAALAD2RIMKLAKMT2A
SCHEMBL17384176 0.93 FOLH1 (0.60) GNPATFOLH1NAALAD2RIMKLAKMT2A
SCHEMBL21387151 0.89 GNPAT (0.57) GNPATFOLH1NAALAD2RIMKLAKMT2A
SCHEMBL7046058 0.89 GNPAT (0.57) GNPATFOLH1NAALAD2RIMKLAKMT2A
SCHEMBL7045832 0.89 GNPAT (0.57) GNPATFOLH1NAALAD2RIMKLAKMT2A
SCHEMBL1533825 0.88 FOLH1 (0.69) GNPATFOLH1NAALAD2RIMKLANOD1
SCHEMBL6270974 0.88 FOLH1 (0.69) GNPATFOLH1NAALAD2RIMKLANOD1
SCHEMBL24805419 0.88 NOD1 (0.58) GNPATFOLH1NAALAD2RIMKLANOD1
SCHEMBL6889134 0.88 NOD1 (0.58) GNPATFOLH1NAALAD2RIMKLANOD1
SCHEMBL7602122 0.88 NOD1 (0.58) GNPATFOLH1NAALAD2RIMKLANOD1

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-0815833-B1 Malodour preventing agents GIVAUDAN SA (CH) 2003-04-09 EP claimed
US-6150542-A COSMETICS; IN DEODORIZERS, ANTIPERSPIRANTS GIVAUDAN ROURE (INTERNATIONAL) SA (CH) 2000-11-21 US claimed
US-5925339-A ODORLESS DEODORANTS AND ANTIPERSPIRANTS GIVAUDAN ROURE SA (CH) 1999-07-20 US claimed
EP-0815833-A2 Malodour preventing agents GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1998-01-07 EP claimed
EP-0815833-B1 Malodour preventing agents GIVAUDAN SA (CH) 2003-04-09 EP disclosed
US-6150542-A COSMETICS; IN DEODORIZERS, ANTIPERSPIRANTS GIVAUDAN ROURE (INTERNATIONAL) SA (CH) 2000-11-21 US disclosed
US-5925339-A ODORLESS DEODORANTS AND ANTIPERSPIRANTS GIVAUDAN ROURE SA (CH) 1999-07-20 US disclosed
EP-0815833-A2 Malodour preventing agents GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1998-01-07 EP disclosed