SCHEMBL1703996

SCHEMBL1703996

CC(C)CCCCC(=O)O.CC(C)CCCCC(=O)OCC(O)CO

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.60
DUSP3 P51452 1/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
LMNA P02545 1/20 0.60
DGKA P23743 1/20 0.52
FAAH O00519 4/20 0.47
MAPT P10636 1/20 0.44
FFAR4 Q5NUL3 1/20 0.42
FFAR1 O14842 1/20 0.42
KDM4C Q9H3R0 2/20 0.41
KDM4A O75164 1/20 0.41
PHF8 Q9UPP1 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
LPAR6 P43657 1/20 0.40
LPAR1 Q92633 1/20 0.40
LPAR4 Q99677 1/20 0.40
LPAR5 Q9H1C0 1/20 0.40
LPAR2 Q9HBW0 1/20 0.40
LPAR3 Q9UBY5 1/20 0.40

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
SCHEMBL483603 1.00 KDM4E (0.60) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL30099173 0.98 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL30923587 0.98 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL1695888 0.98 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL28762308 0.98 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL579964 0.98 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL609590 0.94 KDM4E (0.68) KDM4EDUSP3MEN1KMT2ALMNA
Stearic Acid SCHEMBL30063427 0.93 KDM4E (0.74) KDM4EDUSP3MEN1KMT2ALMNA
Myristic Acid SCHEMBL8885381 0.93 KDM4E (0.74) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL29791959 0.93 KDM4E (0.74) KDM4EDUSP3MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3492514-B1 NOVEL SILICONE COMPOUND AND COSMETIC CONTAINING SAME SHINETSU CHEMICAL CO (JP) 2023-05-10 EP disclosed
US-10787544-B2 Silicone compound and cosmetic containing the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-09-29 US disclosed
US-20190211156-A1 NOVEL SILICONE COMPOUND AND COSMETIC CONTAINING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-07-11 US disclosed
EP-3492514-A1 NOVEL SILICONE COMPOUND AND COSMETIC CONTAINING SAME Shin-Etsu Chemical Co., Ltd. (JP) 2019-06-05 EP disclosed
US-9890252-B2 Silicone compound and cosmetic containing thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-02-13 US disclosed
EP-3168255-B1 NOVEL SILICONE COMPOUND AND COSMETIC CONTAINING THEREOF SHINETSU CHEMICAL CO (JP) 2018-01-31 EP disclosed
EP-2641929-B1 NOVEL ORGANOPOLYSILOXANE, COSMETIC CONTAINING THEREOF, AND METHOD FOR PREPARING ORGANOPOLYSILOXANE SHINETSU CHEMICAL CO (JP) 2017-11-29 EP disclosed
EP-2662400-B1 Block type-modified organopolysiloxane, method for using the organopolysiloxane, cosmetic, and method for producing the organopolysiloxane SHINETSU CHEMICAL CO (JP) 2017-09-13 EP disclosed
CN-103356403-B Cosmetic 信越化学工业株式会社 2017-07-28 CN disclosed
US-20170137574-A1 NOVEL SILICONE COMPOUND AND COSMETIC CONTAINING THEREOF SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-05-18 US disclosed
EP-2641929-A2 Novel organopolysiloxane, cosmetic containing thereof, and method for preparing organopolysiloxane Shin-Etsu Chemical Co., Ltd. (JP) 2013-09-25 EP disclosed
EP-2581401-A1 Glycerol group-containing organopolysiloxane, cosmetic, and method for producing glycerol group-containing organopolysiloxane Shin-Etsu Chemical Co., Ltd. (JP) 2013-04-17 EP disclosed
US-20130089509-A1 GLYCEROL GROUP-CONTAINING ORGANOPOLYSILOXANE, COSMETIC, AND METHOD FOR PRODUCING GLYCEROL GROUP-CONTAINING ORGANOPOLYSILOXANE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-04-11 US disclosed
EP-2030966-B1 BENZYLIDENE MALONAMIDE AND SALT THEREOF, ULTRAVIOLET RAY ABSORBENT, AND AGENT FOR EXTERNAL APPLICATION TO THE SKIN SHISEIDO CO LTD (JP) 2013-01-02 EP disclosed
US-20120093746-A1 AMINO ACID-MODIFIED ORGANOPOLYSILOXANE, MAKING METHOD, AND COSMETICS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-04-19 US disclosed
EP-2441790-A1 Amino acid-modified organopolysiloxane, making method, and cosmetics Shin-Etsu Chemical Co., Ltd. (JP) 2012-04-18 EP disclosed
US-8003083-B2 Benzylidene malonamide and salt thereof, ultraviolet ray absorbent, and agent for external application to the skin SHISEIDO COMPANY, LTD. (JP) 2011-08-23 US disclosed
US-20100254921-A1 Benzylidene Malonamide And Salt Thereof, Ultraviolet Ray Absorbent, And Agent For External Application To The Skin SHISEIDO COMPANY, LTD. (JP) 2010-10-07 US disclosed
EP-2030966-A1 BENZYLIDENE MALONAMIDE AND SALT THEREOF, ULTRAVIOLET RAY ABSORBENT, AND AGENT FOR EXTERNAL APPLICATION TO THE SKIN SHISEIDO COMPANY, LTD. (JP) 2009-03-04 EP disclosed
EP-1095959-A2 Cosmetic composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-05-02 EP 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 (6 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-20170137574-A1 NOVEL SILICONE COMPOUND AND COSMETIC CONTAINING THEREOF CCND2, MRGPRX1, MRGPRX2 KDM4E 1256/4885DUSP3 4803/4885MEN1 1135/4885
US-20120093746-A1 AMINO ACID-MODIFIED ORGANOPOLYSILOXANE, MAKING METHOD, AND COSMETICS DAO, AADAT, BCAT2 KDM4E 1444/4885DUSP3 4857/4885MEN1 1823/4885
US-20100254921-A1 Benzylidene Malonamide And Salt Thereof, Ultraviolet Ray Absorbent, And Agent For External Application To The Skin UROD, MAL2, SI KDM4E 115/4885DUSP3 3972/4885MEN1 692/4885
US-20190211156-A1 NOVEL SILICONE COMPOUND AND COSMETIC CONTAINING THE SAME CCND2, SRD5A1, DRD1 KDM4E 1524/4885DUSP3 4879/4885MEN1 618/4885
US-20130089509-A1 GLYCEROL GROUP-CONTAINING ORGANOPOLYSILOXANE, COSMETIC, AND METHOD FOR PRODUCING GLYCEROL GROUP-CONTAINING ORGANOPOLYSILOXANE GK, MGLL, MRGPRX2 KDM4E 3234/4885DUSP3 4868/4885MEN1 2149/4885
US-10787544-B2 Silicone compound and cosmetic containing the same FANCD2, CCND2, MRGPRX1 KDM4E 1514/4885DUSP3 4874/4885MEN1 606/4885

“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.