SCHEMBL4660141

SCHEMBL4660141

CCCC(C)(C)C(C)(N)O.CCCCCCCCCCCCCCCCCCCCCC(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
FAAH O00519 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
KDM4E B2RXH2 2/20 0.46
CES2 O00748 3/20 0.42
CES1 P23141 3/20 0.42
SMPD1 P17405 2/20 0.42
FDPS P14324 1/20 0.42
PPARG P37231 6/20 0.41
PPARD Q03181 6/20 0.41
PPARA Q07869 6/20 0.41
GPR84 Q9NQS5 5/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
ALDH1A1 P00352 2/20 0.41

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
Hydrochloric Acid SCHEMBL1958104 0.98 SOAT1 (0.49) SOAT1MEN1KMT2AFAAHTP53
SCHEMBL7169876 0.78 FDPS (0.47) SMPD1FDPS
Octadecanoic Acid Amide SCHEMBL8018513 0.78 SOAT1 (0.68) SOAT1MEN1KMT2AFAAHTP53
SCHEMBL6046254 0.78 SOAT1 (0.74) SOAT1MEN1KMT2AFAAHTP53
Octadecanoic Acid Amide SCHEMBL8417300 0.78 SOAT1 (0.74) SOAT1MEN1KMT2AFAAHTP53
SCHEMBL8743286 0.78 SOAT1 (0.74) SOAT1MEN1KMT2AFAAHTP53
SCHEMBL42192 0.78 SOAT1 (0.74) SOAT1MEN1KMT2AFAAHTP53
SCHEMBL22319678 0.78 SOAT1 (0.74) SOAT1MEN1KMT2AFAAHTP53
SCHEMBL2048989 0.78 SOAT1 (0.74) SOAT1MEN1KMT2AFAAHTP53
SCHEMBL2876770 0.78 SOAT1 (0.74) SOAT1MEN1KMT2AFAAHTP53

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
EP-2516510-A1 SURFACE-TREATMENT AGENT FOR POWDER FOR USE IN COSMETIC AND COSMETIC CONTAINING POWDER TREATED WITH THE SAME Dow Corning Toray Co., Ltd. (JP) 2012-10-31 EP disclosed
EP-1449510-B1 HAIR CARE PRODUCTS SHINETSU CHEMICAL CO (JP) 2008-12-17 EP disclosed
US-20070172443-A1 ANTI-CHLORINE SHAMPOO COMPOSITION LITMAN LUCIA M 2007-07-26 US disclosed
US-7244453-B1 Anti-chlorine shampoo composition LITMAN LUCIA MIHALCHICK 2007-07-17 US disclosed
US-20050053570-A1 Hair care products SHIN-ETSU CHEMICAL CO., LTD. OF (JP) 2005-03-10 US disclosed
EP-1449510-A1 HAIR CARE PRODUCTS Shin-Etsu Chemical Company, Ltd. (JP) 2004-08-25 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 (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-20050053570-A1 Hair care products POLR1C, OXSR1, OR10J3 SOAT1 397/4885MEN1 3060/4885KMT2A 2140/4885

“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.