SCHEMBL4393968

SCHEMBL4393968

CCCCc1ccc(NC(C)=O)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.51
SKP2 Q13309 1/20 0.50
POLB P06746 1/20 0.48
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PANK3 Q9H999 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
CYP4Z1 Q86W10 1/20 0.47
CYP4F11 Q9HBI6 1/20 0.47
CYP4F12 Q9HCS2 1/20 0.47
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
METAP2 P50579 1/20 0.44
PLK1 P53350 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL29715987 1.00 ESR1 (0.51) ESR1SKP2POLBCYP3A4CYP2D6
SCHEMBL3406984 0.88 POLB (0.48) SKP2POLBCYP3A4CYP2D6CYP2C9
SCHEMBL21003290 0.86 SKP2 (0.53) SKP2POLBCYP3A4CYP2D6CYP2C9
SCHEMBL6829715 0.86 SKP2 (0.53) SKP2POLBCYP3A4CYP2D6CYP2C9
SCHEMBL9979434 0.85 PLK1 (0.52) SKP2MEN1KMT2APLK1
SCHEMBL14831584 0.84 GAA (0.51) SKP2POLBCYP3A4CYP2D6CYP2C9
SCHEMBL7903540 0.83 ESR1 (0.52) ESR1POLBCYP3A4CYP2C9MEN1
SCHEMBL10750344 0.83 CYP4Z1 (0.49) ESR1KMT2ACYP4Z1CYP4F11CYP4F12
SCHEMBL12598866 0.83 CA1 (0.50) SKP2POLBALDH1A1HPGDMETAP2
SCHEMBL2748823 0.83 CA1 (0.49) POLBALDH1A1HPGDMETAP2PLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2954896-A1 Small molecule inhibitors of the E3 Ligase Skp2 in depression and other diseases Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-12-16 EP claimed
US-20220347277-A1 Methods to Enhance Tumor Immunogenicity and Compositions for Autologous Cancer Immunotherapeutic Products Using Modified Tumor Cells and Modified Dendritic Cells AIVITA BIOMEDICAL INC (US) 2022-11-03 US disclosed
WO-2021050547-A1 MITOCHONDRIAL COMPLEX I INHIBITORS AND METHODS OF USE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-03-18 WO disclosed
US-20200230219-A1 Methods to Enhance Tumor Immunogenicity and Compositions for Autologous Cancer Immunotherapeutic Products Using Modified Tumor Cells and Modified Dendritic Cells AIVITA BIOMEDICAL, INC. 2020-07-23 US disclosed
WO-2018151813-A1 METHODS TO ENHANCE TUMOR IMMUNOGENICITY AND COMPOSITIONS FOR AUTOLOGOUS CANCER IMMUNOTHERAPEUTIC PRODUCTS USING MODIFIED TUMOR CELLS AND MODIFIED DENDRITIC CELLS AIVITA BIOMEDICAL, INC. (US) 2018-08-23 WO disclosed
EP-2954896-A1 Small molecule inhibitors of the E3 Ligase Skp2 in depression and other diseases Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-12-16 EP disclosed
EP-2954896-A1 Small molecule inhibitors of the E3 Ligase Skp2 in depression and other diseases Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-12-16 EP disclosed
US-20090054312-A1 SMIPs: Small molecule inhibitors of p27 depletion in cancers and other proliferative diseases NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-02-26 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 (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-20090054312-A1 SMIPs: Small molecule inhibitors of p27 depletion in cancers and other proliferative diseases CDKN1A, CDK4, CDK2 ESR1 1987/4885SKP2 6/4885POLB 355/4885

“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.