SCHEMBL640740

SCHEMBL640740

CCCCCCCCCCCCCCCCCCCCCC[N+](CC)(CC)CC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 6/20 1.00
SLC22A1 O15245 3/20 0.81
ALDH1A1 P00352 1/20 0.77
TP53 P04637 1/20 0.77
CYP3A4 P08684 1/20 0.77
ALOX15 P16050 1/20 0.77
TSHR P16473 1/20 0.77
ALOX12 P18054 1/20 0.77
SMN1; SMN2 Q16637 1/20 0.77
HIF1A Q16665 1/20 0.77
HSD17B10 Q99714 1/20 0.77
SLC22A2 O15244 1/20 0.75
HTT P42858 1/20 0.57
KMT2A Q03164 1/20 0.57

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
SCHEMBL17418374 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL331847 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL5304363 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL1010481 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL1842974 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL923926 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL332106 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL332945 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL5300928 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4
SCHEMBL5287730 1.00 DNM1 (1.00) DNM1SLC22A1ALDH1A1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11771632-B2 Skin- or hair-cleansing composition containing aqueous gelling agent, and methods for producing aqueous gelling agent and cleansing composition ADEKA CORPORATION (JP) 2023-10-03 US disclosed
US-11464730-B2 Cosmetic composition containing aqueous gelling agent, and method for producing aqueous gelling agent and cosmetic composition ADEKA CORPORATION (JP) 2022-10-11 US disclosed
US-20220257496-A1 HAIR COSMETIC COMPOSITION CONTAINING AQUEOUS GELLING AGENT, AND METHOD FOR PRODUCING AQUEOUS GELLING AGENT AND HAIR COSMETIC COMPOSITION ADEKA CORPORATION (JP) 2022-08-18 US disclosed
US-20220160603-A1 SKIN- OR HAIR-CLEANSING COMPOSITION CONTAINING AQUEOUS GELLING AGENT, AND METHODS FOR PRODUCING AQUEOUS GELLING AGENT AND CLEANSING COMPOSITION ADEKA CORPORATION (JP) 2022-05-26 US disclosed
US-8119195-B2 Mixture containing quaternary ammonium compound and its use AKZO NOBEL N.V. (NL) 2012-02-21 US disclosed
US-20100267874-A1 MIXTURE CONTAINING QUATERNARY AMMONIUM COMPOUND AND ITS USE AKZO NOBEL N.V. (NL) 2010-10-21 US disclosed
WO-1996035760-A1 BLEED RESISTANT CYANATE ESTER-CONTAINING COMPOSITIONS QUANTUM MATERIALS, INC. (US) 1996-11-14 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 (4 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-11771632-B2 Skin- or hair-cleansing composition containing aqueous gelling agent, and methods for producing aqueous gelling agent and cleansing composition CUTA, POLR1C, SHH DNM1 3763/4885SLC22A1 1954/4885ALDH1A1 1927/4885
US-20220160603-A1 SKIN- OR HAIR-CLEANSING COMPOSITION CONTAINING AQUEOUS GELLING AGENT, AND METHODS FOR PRODUCING AQUEOUS GELLING AGENT AND CLEANSING COMPOSITION CUTA, POLR1C, SHH DNM1 3763/4885SLC22A1 1954/4885ALDH1A1 1927/4885
US-20220257496-A1 HAIR COSMETIC COMPOSITION CONTAINING AQUEOUS GELLING AGENT, AND METHOD FOR PRODUCING AQUEOUS GELLING AGENT AND HAIR COSMETIC COMPOSITION CUTA, POLR1C, SHH DNM1 2691/4885SLC22A1 1420/4885ALDH1A1 878/4885
US-11464730-B2 Cosmetic composition containing aqueous gelling agent, and method for producing aqueous gelling agent and cosmetic composition CUTA, COL1A1, CRYAA DNM1 3830/4885SLC22A1 3142/4885ALDH1A1 788/4885

“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.