SCHEMBL723543

SCHEMBL723543

CCCCc1ccc(O)c(-c2cc(CCCC)ccc2O)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.77
CNR2 P34972 1/20 0.77
NPC1 O15118 2/20 0.59
MAPK1 P28482 2/20 0.59
RAB9A P51151 2/20 0.59
HPGD P15428 1/20 0.59
HTT P42858 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
ALOX5 P09917 1/20 0.54
IGF1R P08069 2/20 0.54
ALOX15 P16050 2/20 0.54
KAT8 Q9H7Z6 2/20 0.53
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
IAPP P10997 1/20 0.50
PPARA Q07869 1/20 0.49
SKP2 Q13309 1/20 0.48
ESR1 P03372 2/20 0.48
ADRA2A P08913 2/20 0.48
ADORA3 P0DMS8 2/20 0.48

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
SCHEMBL2938428 0.92 CNR1 (0.71) CNR1CNR2IGF1RALOX15KAT8
SCHEMBL28653265 0.89 CNR1 (0.61) CNR1CNR2NPC1MAPK1RAB9A
SCHEMBL662610 0.87 CNR1 (1.00) CNR1CNR2HPGDNPSR1ALOX5
SCHEMBL29380189 0.87 CNR1 (1.00) CNR1CNR2HPGDNPSR1ALOX5
SCHEMBL8940800 0.87 GABRA1 (0.60) CNR1CNR2MAPK1ALOX5LMNA
Magnolol SCHEMBL5511922 0.87 GABRA1 (0.72) CNR1CNR2NPC1MAPK1RAB9A
SCHEMBL4591101 0.86 BACE1 (0.66) CNR1CNR2NPC1MAPK1RAB9A
SCHEMBL9818748 0.86 ALOX5 (0.58) CNR1CNR2NPC1MAPK1RAB9A
SCHEMBL7083434 0.86 CNR1 (0.58) CNR1CNR2NPC1MAPK1RAB9A
SCHEMBL20429859 0.85 CNR1 (0.57) CNR1CNR2NPC1MAPK1RAB9A

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 67 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2539022-B1 ORAL CARE COMPOSITIONS COMPRISING MAGNOLIA BARK EXTRACT OR A SYNTHETIC ANALOG THEREOF COLGATE PALMOLIVE CO (US) 2018-08-01 EP claimed
CN-104053663-B Process for purifying organodiphosphite compounds 巴斯夫欧洲公司 2017-07-04 CN claimed
EP-2539022-A2 ORAL CARE COMPOSITIONS COMPRISING MAGNOLIA BARK EXTRACT OR A SYNTHETIC ANALOG THEREOF Colgate-Palmolive Company (US) 2013-01-02 EP claimed
US-20120308489-A1 ORAL CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2012-12-06 US claimed
US-20120294812-A1 ORAL CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2012-11-22 US claimed
EP-2523676-A1 ORAL CARE COMPOSITIONS Colgate-Palmolive Company (US) 2012-11-21 EP claimed
WO-2011106493-A2 ORAL CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2011-09-01 WO claimed
WO-2011106492-A1 ORAL CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2011-09-01 WO claimed
EP-2539022-B1 ORAL CARE COMPOSITIONS COMPRISING MAGNOLIA BARK EXTRACT OR A SYNTHETIC ANALOG THEREOF COLGATE PALMOLIVE CO (US) 2018-08-01 EP disclosed
EP-2539022-B1 ORAL CARE COMPOSITIONS COMPRISING MAGNOLIA BARK EXTRACT OR A SYNTHETIC ANALOG THEREOF COLGATE PALMOLIVE CO (US) 2018-08-01 EP disclosed
US-9801940-B2 Oral care compositions COLGATE-PALMOLIVE COMPANY (US) 2017-10-31 US disclosed
US-9801940-B2 Oral care compositions COLGATE-PALMOLIVE COMPANY (US) 2017-10-31 US disclosed
US-9801940-B2 Oral care compositions COLGATE-PALMOLIVE COMPANY (US) 2017-10-31 US disclosed
EP-2790650-B1 SOLUBILIZED MAGNOLOL ANALOGS COLGATE PALMOLIVE CO (US) 2017-05-24 EP disclosed
WO-2011075136-A1 CHALCONES AS ENHANCER OF ANTIMICROBIAL AGENTS COLGATE-PALMOLIVE COMPANY (US) 2011-06-23 WO disclosed
EP-2266666-A1 Oral compositions containing biphenol antibacterial compounds Colgate-Palmolive Company (US) 2010-12-29 EP disclosed
EP-2266666-A1 Oral compositions containing biphenol antibacterial compounds Colgate-Palmolive Company (US) 2010-12-29 EP disclosed
EP-1830925-A1 ORAL COMPOSITIONS CONTAINING BIPHENOL ANTIBACTERIAL COMPOUNDS Colgate-Palmolive Company (US) 2007-09-12 EP disclosed
WO-2006071654-A1 ORAL COMPOSITIONS CONTAINING BIPHENOL ANTIBACTERIAL COMPOUNDS COLGATE-PALMOLIVE COMPANY (US) 2006-07-06 WO disclosed
US-20060140880-A1 Oral compositions containing biphenol antibacterial compounds COLGATE-PALMOLIVE 2006-06-29 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-20120294812-A1 ORAL CARE COMPOSITIONS MLEC, TAS2R40, FHIT CNR1 4307/4885CNR2 4300/4885NPC1 195/4885
US-20120308489-A1 ORAL CARE COMPOSITIONS MLEC, TAS2R40, FHIT CNR1 4307/4885CNR2 4300/4885NPC1 195/4885
US-20060140880-A1 Oral compositions containing biphenol antibacterial compounds BPGM, ABCB11, UGT1A10 CNR1 3087/4885CNR2 3431/4885NPC1 1339/4885

“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.