SCHEMBL2214933

SCHEMBL2214933

CCCCCCCCOC(=O)[C@@H](N)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.52
TSHR P16473 3/20 0.52
EPHX1 P07099 1/20 0.48
HTR2C P28335 1/20 0.46
HCAR2 Q8TDS4 1/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
FAAH O00519 1/20 0.43
LMNA P02545 1/20 0.43
ACHE P22303 5/20 0.43

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
SCHEMBL31584710 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL7782942 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL31584796 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL31584462 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL18672810 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL2214927 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL7781605 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL7782136 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL7782139 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2
SCHEMBL7782944 1.00 NAAA (0.52) NAAATSHREPHX1HTR2CHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113677337-B Cationic compositions based on self-neutralizing amino acids 伊诺莱克斯投资公司 2025-05-23 CN claimed
US-10905683-B2 Compositions and uses of amidine derivatives BIOCRYST PHARMACEUTICALS, INC. (US) 2021-02-02 US disclosed
US-20170266172-A1 Compositions and Uses of Amidine Derivatives WILMINGTON TRUST, NATIONAL ASSOCIATION 2017-09-21 US disclosed
US-20130245246-A1 POLYSACCHARIDES COMPRISING CARBOXYL FUNCTIONAL GROUPS SUBSTITUTED BY A HYDROPHOBIC ALCOHOL DERIVATIVE ADOCIA (FR) 2013-09-19 US disclosed
US-20110178011-A1 Polysaccharide/BMP complexes which are soluble at physiological pH ADOCIA (FR) 2011-07-21 US 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-20130245246-A1 POLYSACCHARIDES COMPRISING CARBOXYL FUNCTIONAL GROUPS SUBSTITUTED BY A HYDROPHOBIC ALCOHOL DERIVATIVE CD44, B3GAT3, UGCG NAAA 747/4885TSHR 1591/4885EPHX1 3629/4885
US-10905683-B2 Compositions and uses of amidine derivatives HRH3, HRH2, HRH1 NAAA 197/4885TSHR 1832/4885EPHX1 208/4885
US-20170266172-A1 Compositions and Uses of Amidine Derivatives HRH3, HRH2, HRH1 NAAA 197/4885TSHR 1832/4885EPHX1 208/4885
US-20110178011-A1 Polysaccharide/BMP complexes which are soluble at physiological pH BMP1, BMP2, BMP6 NAAA 3580/4885TSHR 2272/4885EPHX1 3942/4885

“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.