SCHEMBL345697

SCHEMBL345697

CCCCCCCC/C=C/C(C)CCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
CYP3A4 P08684 1/20 0.50
SPHK2 Q9NRA0 4/20 0.47
SPHK1 Q9NYA1 4/20 0.47
MAPT P10636 3/20 0.47
CETP P11597 3/20 0.47
GMNN O75496 2/20 0.47
LMNA P02545 2/20 0.47
GLA P06280 2/20 0.47
POLB P06746 2/20 0.47
THRB P10828 2/20 0.47
MAPK1 P28482 2/20 0.47
CXCR5 P32302 2/20 0.47
CCR6 P51684 2/20 0.47
BLM P54132 2/20 0.47
UBE2N P61088 2/20 0.47
CYP2D6 P10635 2/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL11973485 1.00 MEN1 (0.50) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL11973486 1.00 MEN1 (0.50) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL345698 1.00 MEN1 (0.50) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL2007244 0.98 MEN1 (0.47) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL2007242 0.98 MEN1 (0.47) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL19140607 0.93 MEN1 (0.48) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL9545645 0.93 MEN1 (0.48) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL21643925 0.93 MEN1 (0.48) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL5073456 0.93 MEN1 (0.48) MEN1KMT2ACYP3A4SPHK2SPHK1
SCHEMBL21643923 0.93 MEN1 (0.48) MEN1KMT2ACYP3A4SPHK2SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103687583-B The method of cleaning hair 宝洁公司 2016-08-17 CN disclosed
CN-103228252-B Comprise the composition and method of making the same of near-end hyperbranched compounds THE PROCTER & GAMBLE CO. (US) 2016-01-20 CN disclosed
CN-103228253-B A personal care composition comprising a near-erminal branched compound PROCTER & GAMBLE 2015-05-06 CN disclosed
US-8883698-B2 Compositions comprising a near terminal-branched compound and methods of making the same THE PROCTER & GAMBLE CO (US) 2014-11-11 US disclosed
US-8765651-B2 Method of cleansing hair THE PROCTER & GAMBLE COMPANY (US) 2014-07-01 US disclosed
CN-103687583-A Method of cleansing hair PROCTER & GAMBLE 2014-03-26 CN disclosed
US-8603449-B2 Rinse-off conditioning composition comprising a near-terminal branched alcohol THE PROCTER & GAMBLE COMPANY (US) 2013-12-10 US disclosed
CN-103228252-A Compositions comprising a near terminal-ranched compound and methods of making the same PROCTER & GAMBLE 2013-07-31 CN disclosed
CN-103228253-A A personal care composition comprising a near-erminal branched compound PROCTER & GAMBLE 2013-07-31 CN disclosed
EP-2593074-A2 COMPOSITIONS COMPRISING A NEAR TERMINAL-BRANCHED COMPOUND AND METHODS OF MAKING THE SAME The Procter and Gamble Company (US) 2013-05-22 EP disclosed
US-20130053300-A1 Compositions Comprising A Near Terminal-Branched Compound And Methods Of Making The Same THE PROCTER & GAMBLE COMPANY 2013-02-28 US disclosed
US-20120012130-A1 Method of Cleansing Hair THE PROCTER & GAMBLE COMPANY 2012-01-19 US disclosed
US-20120014901-A1 Rinse-Off Conditioning Composition Comprising a Near-Terminal Branched Alcohol THE PROCTER & GAMBLE COMPANY 2012-01-19 US disclosed
WO-2012009525-A2 COMPOSITIONS COMPRISING A NEAR TERMINAL-BRANCHED COMPOUND AND METHODS OF MAKING THE SAME THE PROCTER & GAMBLE COMPANY (US) 2012-01-19 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 (2 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-20120012130-A1 Method of Cleansing Hair POLR1C, SHH, LATS2 MEN1 4490/4885KMT2A 2739/4885CYP3A4 2494/4885
US-20120014901-A1 Rinse-Off Conditioning Composition Comprising a Near-Terminal Branched Alcohol ITGB7, ARG1, ITGB1 MEN1 2791/4885KMT2A 3602/4885CYP3A4 4715/4885

“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.