SCHEMBL3483396

SCHEMBL3483396

CCCCCCCCCCCCCCCCCCOCCOC(C)CCCCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
EPHX2 P34913 1/20 0.41
USP2 O75604 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
CES2 O00748 1/20 0.38
DNM1 Q05193 1/20 0.38
FAAH O00519 4/20 0.38
PLA2G2A P14555 1/20 0.37
OPRM1 P35372 1/20 0.37
LPAR1 Q92633 3/20 0.37
LPAR3 Q9UBY5 3/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
PLA2G2C Q5R387 1/20 0.37

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
SCHEMBL19970472 0.96 HTT (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL23075729 0.90 OPRM1 (0.40) HTTMEN1THRBKMT2AMAPT
SCHEMBL10350856 0.87 DNM1 (0.48) THRBEPHX2SPHK1DNM1FAAH
SCHEMBL9136425 0.87 DNM1 (0.48) THRBEPHX2SPHK1DNM1FAAH
SCHEMBL690816 0.87 DNM1 (0.48) THRBEPHX2SPHK1DNM1FAAH
SCHEMBL4022359 0.87 DNM1 (0.48) THRBEPHX2SPHK1DNM1FAAH
SCHEMBL17253503 0.87 DNM1 (0.48) THRBEPHX2SPHK1DNM1FAAH
SCHEMBL19219115 0.87 DNM1 (0.48) THRBEPHX2SPHK1DNM1FAAH
SCHEMBL11673316 0.87 DNM1 (0.48) THRBEPHX2SPHK1DNM1FAAH
SCHEMBL3039218 0.87 DNM1 (0.48) THRBEPHX2SPHK1DNM1FAAH

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
US-9655824-B2 Use of diphenylmethane derivatives as tyrosinase inhibitors SYMRISE AG (DE) 2017-05-23 US disclosed
US-9526687-B2 Polymers based on sulfonic acids, amides and special cross-linking agents CLARIANT INTERNATIONAL LTD. (CH) 2016-12-27 US disclosed
US-20140086854-A1 Polymers Based On Sulfonic Acids, Amides And Special Cross-Linking Agents CLARIANT FINANCE (BVI) LIMITED (VG) 2014-03-27 US disclosed
US-8409552-B2 Anthranillic acid amides and derivatives thereof as cosmetic and pharmaceutical active compounds SYMRISE AG (DE) 2013-04-02 US disclosed
US-20120315233-A1 ANTHRANILLIC ACID AMIDES AND DERIVATIVES THEREOF AS COSMETIC AND PHARMACEUTICAL ACTIVE COMPOUNDS SYMRISE AG (DE) 2012-12-13 US disclosed
US-8241681-B2 Synergistic mixtures of bisabolol and ginger extract SYMRISE AG (DE) 2012-08-14 US disclosed
US-8203016-B2 Anthranilic acid amides and derivatives thereof as cosmetic and pharmaceutical agents SYMRISE AG (DE) 2012-06-19 US disclosed
US-20100216892-A1 Use of synergistically active 1,2-alkanediol mixtures as skin moisture-regulating compositions SYMRISE GMBH & CO. KG (DE) 2010-08-26 US disclosed
US-20090220625-A1 SYNERGISTIC MIXTURES OF BISABOLOL AND GINGER EXTRACT SYMRISE AG (DE) 2009-09-03 US disclosed
US-7582681-B2 Synergistic mixtures of 1,2-alkane diols SYMRISE GMBH & CO. KG (DE) 2009-09-01 US disclosed
EP-1937366-A1 SYNERGISTIC MIXTURES OF BISABOLOL AND GINGER EXTRACT Symrise GmbH & Co. KG (DE) 2008-07-02 EP disclosed
EP-1835843-A1 USE OF SYNERGISTICALLY ACTIVE 1,2-ALKANEDIOL MIXTURES AS SKIN MOISTURE-REGULATING COMPOSITIONS Symrise GmbH & Co. KG (DE) 2007-09-26 EP disclosed
US-20070098655-A1 Use of diphenylmethane derivatives as tyrosinase inhibitors SYMRISE AG (DE) 2007-05-03 US disclosed
WO-2007042472-A1 SYNERGISTIC MIXTURES OF BISABOLOL AND GINGER EXTRACT SYMRISE GMBH & CO. KG (DE) 2007-04-19 WO disclosed
WO-2006069953-A1 USE OF SYNERGISTICALLY ACTIVE 1, 2-ALKANEDIOL MIXTURES AS SKIN MOISTURE-REGULATING COMPOSITIONS SYMRISE GMBH & CO. KG (DE) 2006-07-06 WO disclosed
US-20060089413-A1 Anthranilic acid amides and derivatives thereof as cosmetic and pharmaceutical agents SYMRISE GMBH & CO. KG (DE) 2006-04-27 US disclosed
US-20050222276-A1 Synergistic mixtures of 1,2-alkane diols SYMRISE AG (DE) 2005-10-06 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 (5 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-20050222276-A1 Synergistic mixtures of 1,2-alkane diols BAK1, ERG28, ADH1A HTT 4778/4885MEN1 1326/4885THRB 2742/4885
US-20060089413-A1 Anthranilic acid amides and derivatives thereof as cosmetic and pharmaceutical agents HRH1, CMA1, HRH2 HTT 2533/4885MEN1 1771/4885THRB 4403/4885
US-20140086854-A1 Polymers Based On Sulfonic Acids, Amides And Special Cross-Linking Agents ACMSD, SRM, TAS1R1 HTT 884/4885MEN1 2109/4885THRB 4471/4885
US-20120315233-A1 ANTHRANILLIC ACID AMIDES AND DERIVATIVES THEREOF AS COSMETIC AND PHARMACEUTICAL ACTIVE COMPOUNDS CMA1, TPSAB1, HRH1 HTT 2046/4885MEN1 1612/4885THRB 4482/4885
US-20070098655-A1 Use of diphenylmethane derivatives as tyrosinase inhibitors TYR, DPM1, DDT HTT 2307/4885MEN1 2900/4885THRB 1138/4885

“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.