SCHEMBL1706738

SCHEMBL1706738

OC1COc2ccccc2C1O

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 5/20 0.62
LTB4R2 Q9NPC1 5/20 0.62
CYP3A4 P08684 1/20 0.46
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
NISCH Q9Y2I1 1/20 0.42
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
HTR2B P41595 1/20 0.39
PSMB5 P28074 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.38
HTT P42858 1/20 0.38
SSTR4 P31391 1/20 0.38

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
SCHEMBL30813009 0.81 CYP3A4 (0.58) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL170680 0.81 CYP3A4 (0.58) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL14956962 0.81 CYP3A4 (0.58) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL2070162 0.81 CYP3A4 (0.58) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL6093238 0.81 CYP3A4 (0.58) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL6093233 0.81 CYP3A4 (0.58) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL23505795 0.80 LTB4R (0.46) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL4119534 0.80 LTB4R (0.54) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL14395468 0.80 LTB4R (0.54) LTB4RLTB4R2CYP3A4MAOAMAOB
SCHEMBL4119536 0.80 LTB4R (0.54) LTB4RLTB4R2CYP3A4MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105838758-B Water-soluble phenolic derivatives for cosmetic and therapeutic applications on the skin 利布莱根公司 2020-03-06 CN disclosed
US-9828407-B2 Water soluble and activable phenolic derivatives with dermocosmetic and therapeutic applications and process for preparing said derivatives LIBRAGEN (FR) 2017-11-28 US disclosed
CN-101611148-B Water-soluble phenolic derivatives for cosmetic and therapeutic applications on the skin LIBRAGEN (FR) 2016-03-16 CN disclosed
US-20140088030-A1 WATER SOLUBLE AND ACTIVABLE PHENOLICS DERIVATIVES WITH DERMOCOSMETIC AND THERAPEUTIC APPLICATIONS AND PROCESS FOR PREPARING SAID DERIVATIVES LIBRAGEN (FR) 2014-03-27 US disclosed
EP-2027279-B1 Phenolic compounds with cosmetic and therapeutic applications LIBRAGEN (FR) 2012-04-18 EP disclosed
US-20110183930-A1 WATER SOLUBLE AND ACTIVABLE PHENOLICS DERIVATIVES WITH DERMOCOSMETIC AND THERAPEUTIC APPLICATIONS AND PROCESS FOR PREPARING SAID DERIVATIVES LIBRAGEN (FR) 2011-07-28 US disclosed
US-20090233876-A1 Water Soluble and Activable Phenolics Derivatives with Dermocosmetic and Therapeutic Applications and Process for Preparing Said Derivatives LIBRAGEN (FR) 2009-09-17 US disclosed
EP-2027279-A2 WATER SOLUBLE AND ACTIVABLE PHENOLICS DERIVATIVES WITH DERMOCOSMETIC AND THERAPEUTIC APPLICATIONS AND PROCESS FOR PREPARING SAID DERIVATIVES Libragen (FR) 2009-02-25 EP disclosed
EP-1896443-A1 PREPARATION OF (+)-CATECHIN, (-)-EPICATECHIN, (-)-CATECHIN, (+)-EPICATECHIN, AND THEIR 5,7,3',4'-TETRA-O-BENZYL ANALOGUES MARS, INCORPORATED (US) 2008-03-12 EP disclosed
WO-2007144368-A2 WATER SOLUBLE PHENOLICS DERIVATIVES WITH DERMOCOSMETIC AND THERAPEUTIC APPLICATIONS LIBRAGEN (FR) 2007-12-21 WO disclosed
EP-1867729-A1 Water soluble phenolics derivatives with dermocosmetic and therapeutic applications Libragen (FR) 2007-12-19 EP disclosed
WO-2007002877-A1 PREPARATION OF (+)-CATECHIN, (-)-EPICATECHIN, (-)-CATECHIN, (+)-EPICATECHIN, AND THEIR 5,7,3',4'-TETRA-O-BENZYL ANALOGUES MARS, INCORPORATED (US) 2007-01-04 WO 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-20090233876-A1 Water Soluble and Activable Phenolics Derivatives with Dermocosmetic and Therapeutic Applications and Process for Preparing Said Derivatives UGGT1, TYR, LCT LTB4R 1884/4885LTB4R2 2220/4885CYP3A4 201/4885
US-20110183930-A1 WATER SOLUBLE AND ACTIVABLE PHENOLICS DERIVATIVES WITH DERMOCOSMETIC AND THERAPEUTIC APPLICATIONS AND PROCESS FOR PREPARING SAID DERIVATIVES UGGT1, TYR, G6PD LTB4R 1866/4885LTB4R2 2219/4885CYP3A4 303/4885
US-20140088030-A1 WATER SOLUBLE AND ACTIVABLE PHENOLICS DERIVATIVES WITH DERMOCOSMETIC AND THERAPEUTIC APPLICATIONS AND PROCESS FOR PREPARING SAID DERIVATIVES UGGT1, TYR, G6PD LTB4R 1866/4885LTB4R2 2219/4885CYP3A4 303/4885

“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.