SCHEMBL20857027

SCHEMBL20857027

CCCC(CCC)C(=O)N1CCN(CCNC(=O)O)CC1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.61
TSHR P16473 2/20 0.51
USP2 O75604 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP2C9 P11712 1/20 0.41
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
LMNA P02545 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
POLB P06746 1/20 0.36

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
SCHEMBL22299758 0.81 CYP2C19 (0.53) CYP2C19TSHRUSP2MEN1KMT2A
SCHEMBL20857024 0.80 CYP2C19 (0.55) CYP2C19TSHRUSP2MEN1KMT2A
SCHEMBL20857025 0.78 CYP2C19 (0.48) CYP2C19TSHRUSP2ALDH1A1NPSR1
SCHEMBL20865637 0.77 CYP2C19 (0.48) CYP2C19TSHRUSP2MEN1KMT2A
SCHEMBL20865636 0.77 CYP2C19 (0.51) CYP2C19TSHRUSP2ALDH1A1SMN1; SMN2
SCHEMBL21065340 0.77 CA12 (0.48) CYP2C19MEN1KMT2AALDH1A1KDM4E
SCHEMBL8149825 0.76 CYP2C19 (0.78) CYP2C19TSHRUSP2MEN1KMT2A
SCHEMBL21078258 0.76 HTR1A (0.46) CYP2C19TSHRALDH1A1KDM4ENPSR1
SCHEMBL26209114 0.75 CYP2C19 (0.49) CYP2C19TSHRUSP2KMT2AALDH1A1
SCHEMBL166365 0.73 HDAC2 (0.54) CYP2C19TSHRMEN1KMT2AALDH1A1

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
US-20240016799-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF MEDICON PHARMACEUTICALS, INC. 2024-01-18 US disclosed
US-11752146-B2 Anti-inflammatory, anti-cancer, and anti-angiogenic compounds, pharmaceutical compositions, and methods of making and using thereof MEDICON PHARMACEUTICALS, INC. (US) 2023-09-12 US disclosed
US-20200246330-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF MEDICON PHARMACEUTICALS, INC. (US) 2020-08-06 US disclosed
EP-3687972-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF Medicon Pharmaceuticals, Inc. (US) 2020-08-05 EP disclosed
WO-2019067974-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICALS COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF MEDICAL PHARMACEUTICALS, INC. (US) 2019-04-04 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 (3 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-20200246330-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF VEGFA, HPGDS, ALOX5 CYP2C19 666/4885TSHR 4882/4885USP2 4384/4885
US-11752146-B2 Anti-inflammatory, anti-cancer, and anti-angiogenic compounds, pharmaceutical compositions, and methods of making and using thereof VEGFA, HPGDS, ALOX5 CYP2C19 666/4885TSHR 4882/4885USP2 4384/4885
US-20240016799-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF VEGFA, HPGDS, ALOX5 CYP2C19 666/4885TSHR 4882/4885USP2 4384/4885

“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.