SCHEMBL2585860

SCHEMBL2585860

CCCCC(CC)COC(=O)/C(C#N)=C/c1ccc(-c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.59
LMNA P02545 2/20 0.59
MAPK1 P28482 2/20 0.59
CA2 P00918 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAPT P10636 5/20 0.46
KDM4E B2RXH2 4/20 0.46
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 1/20 0.42
POLB P06746 1/20 0.42
NPC1 O15118 1/20 0.42
CASP3 P42574 1/20 0.42

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
SCHEMBL2585864 1.00 ALDH1A1 (0.59) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL7109914 0.93 ALDH1A1 (0.64) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL7109919 0.93 ALDH1A1 (0.64) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL10644154 0.92 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL15393023 0.91 ALDH1A1 (0.56) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL22466779 0.91 ALDH1A1 (0.56) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL5047159 0.88 ALDH1A1 (0.57) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL5047156 0.88 ALDH1A1 (0.57) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL4139254 0.87 ALDH1A1 (0.53) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL4139257 0.87 ALDH1A1 (0.53) ALDH1A1LMNAMAPK1CA2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250195384-A1 COSMETIC SHISEIDO COMPANY, LTD. (JP) 2025-06-19 US disclosed
US-20230112943-A1 TOPICALLY ADMINISTRABLE LYZATE OF DEDIFFERENTIATED CELLS OF THE PLANT HELICHRYSUM STOECHAS FOR MOISTURIZING THE SKIN Société d'Exploitation de Produits pour les Industries Chimiques SEPPIC (FR) 2023-04-13 US disclosed
EP-3892270-A1 OIL-BASED HUMECTANT AND COMPOSITION FOR EXTERNAL APPLICATION TO SKIN CONTAINING SAME The Nisshin OilliO Group, Ltd. (JP) 2021-10-13 EP disclosed
EP-3087971-A1 STICK-SHAPED BASE MATERIAL CONTAINING LIPID-PEPTIDE COMPOUND Nissan Chemical Industries, Ltd. (JP) 2016-11-02 EP disclosed
EP-2585033-A2 COSMETIC AND TOPICAL SKIN PREPARATION COMPRISING HIGHER ALCOHOL-MODIFIED SILICONE Dow Corning Toray Co., Ltd. (JP) 2013-05-01 EP disclosed
WO-2011136389-A2 COSMETIC AND TOPICAL SKIN PREPARATION COMPRISING HIGHER ALCOHOL-MODIFIED SILICONE DOW CORNING TORAY CO., LTD. (JP) 2011-11-03 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 (1 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-20230112943-A1 TOPICALLY ADMINISTRABLE LYZATE OF DEDIFFERENTIATED CELLS OF THE PLANT HELICHRYSUM STOECHAS FOR MOISTURIZING THE SKIN CUTA, TREH, HES1 ALDH1A1 3414/4885LMNA 815/4885MAPK1 4550/4885

“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.