SCHEMBL4720732

SCHEMBL4720732

C=CCc1cc(C)cc(=O)n1O

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 19/20 0.57

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
SCHEMBL7089306 0.77 IDH1 (0.65) IDH1
SCHEMBL11822962 0.76 IDH1 (0.62) IDH1
SCHEMBL7091685 0.76 IDH1 (0.62) IDH1
SCHEMBL7087597 0.74 IDH1 (0.61) IDH1
SCHEMBL7094059 0.73 IDH1 (0.59) IDH1
SCHEMBL30397140 0.71 IDH1 (0.53) IDH1
SCHEMBL10724156 0.70 KDM4E (0.37) IDH1
SCHEMBL28952245 0.70 IDH1 (0.82) IDH1
Piroctone SCHEMBL3588 0.69 IDH1 (0.50) IDH1
Piroctone SCHEMBL7568492 0.69 IDH1 (0.50) IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101123940-A Preservative agent CLARIANT PRODUKTE DEUTSCHLAND (DE) 2008-02-13 CN claimed
EP-1845934-A1 PRESERVATIVES Clariant Produkte (Deutschland) GmbH (DE) 2007-10-24 EP claimed
WO-2006081969-A1 PRESERVATIVES CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2006-08-10 WO claimed
EP-3383358-B2 CLEANSING BARS COLGATE PALMOLIVE CO (US) 2024-07-03 EP disclosed
EP-3383358-B1 CLEANSING BARS COLGATE PALMOLIVE CO (US) 2021-05-19 EP disclosed
US-8877234-B2 Preservatives CLARIANT FINANCE (BVI) LIMITED (VG) 2014-11-04 US disclosed
US-8877234-B2 Preservatives CLARIANT FINANCE (BVI) LIMITED (VG) 2014-11-04 US disclosed
CN-101123940-B preservative agent CLARIANT PRODUKTE DEUTSCHLAND 2012-05-23 CN disclosed
US-20080312195-A1 Preservatives CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2008-12-18 US disclosed
US-20080312195-A1 Preservatives CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2008-12-18 US disclosed
EP-1845934-B1 PRESERVATIVES CLARIANT PRODUKTE DEUTSCHLAND (DE) 2008-05-14 EP disclosed
EP-1845934-B1 PRESERVATIVES CLARIANT PRODUKTE DEUTSCHLAND (DE) 2008-05-14 EP disclosed
CN-101123940-A Preservative agent CLARIANT PRODUKTE DEUTSCHLAND (DE) 2008-02-13 CN disclosed
EP-1845934-A1 PRESERVATIVES Clariant Produkte (Deutschland) GmbH (DE) 2007-10-24 EP disclosed
EP-1845934-A1 PRESERVATIVES Clariant Produkte (Deutschland) GmbH (DE) 2007-10-24 EP disclosed
WO-2006081969-A1 PRESERVATIVES CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2006-08-10 WO disclosed
WO-2006081969-A1 PRESERVATIVES CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2006-08-10 WO disclosed