SCHEMBL4279283

SCHEMBL4279283

CC(C)C1=CC(=O)CCC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
CYP19A1 P11511 8/20 0.33
NR3C1 P04150 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
HIF1A Q16665 1/20 0.32
EPAS1 Q99814 1/20 0.32
ALDH1A1 P00352 3/20 0.32
LMNA P02545 3/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
SHBG P04278 2/20 0.32
SERPINA6 P08185 2/20 0.32
MAPK1 P28482 2/20 0.32
HSD17B3 P37058 2/20 0.32
SNCA P37840 2/20 0.32
BLM P54132 2/20 0.32
PMP22 Q01453 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
HSD17B10 Q99714 2/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL4279139 0.84 POLB (0.33) POLBCYP19A1NR3C1ALDH1A1LMNA
SCHEMBL4274509 0.77 POLB (0.33) POLBCYP19A1
SCHEMBL4267427 0.76 CYP19A1 (0.32) POLBCYP19A1NR3C1
SCHEMBL4268774 0.73 ALDH1A1 (0.37) ALDH1A1
SCHEMBL857338 0.71 POLB (0.37) POLBCYP19A1ALDH1A1LMNASMN1; SMN2
SCHEMBL4274635 0.71 POLB (0.35) POLBCYP19A1NR3C1ALDH1A1SHBG
SCHEMBL4184971 0.70 ESR1 (0.38) CYP19A1KDM4EMAPTESR1ESR2
SCHEMBL6432193 0.70 POLB (0.36) POLBCYP19A1ALDH1A1LMNASMN1; SMN2
SCHEMBL15426909 0.70 LMNA (0.40) POLBCYP19A1NR3C1ALDH1A1LMNA
SCHEMBL7620452 0.68 POLB (0.39) POLBCYP19A1ALDH1A1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605183-B2 Inhibitory or blocking agents of molecular generating and/or inducing functions KOYAMA SHOZO 2009-10-20 US disclosed
US-20080200558-A1 Inhibitory or blocking agents of molecular generating and/or/ inducing functions KOYAMA SHOZO 2008-08-21 US disclosed
US-20070066654-A1 Inhibitory or blocking agents of molecular generating and/or inducing functions KOYAMA SHOZO 2007-03-22 US disclosed
EP-0780122-B1 DEPRESSANT OF FUNCTIONS DEVELOPED BY MOLECULE KOYAMA SHOZO (JP) 2006-11-22 EP disclosed
US-20040224926-A1 Inhibitory or blocking agents of molecular generating and/or inducing functions KOYAMA SHOZO (JP) 2004-11-11 US disclosed
US-6710090-B2 A CYCLOHEX-1-EN-2-ONE COMPOUND KOYAMA SHOZO (JP) 2004-03-23 US disclosed
US-20020165206-A1 Inhibitory or blocking agents of molecular generating and/or inducing functions KOYAMA SHOZO (JP) 2002-11-07 US disclosed
US-6346551-B1 ANTIBACTERIAL, ANTIFUNGAL, ANTIVIRAL, BACTERICIDAL AND/OR STERILIZATION AGENTS, ANTICANCER DRUGS, BLOOD COAGULATION AND FIBRINOLYSIS INHIBITORS AND/OR BLOCKING AGENTS, INHIBITORY AND/OR BLOCKING AGENTS OF ANTIGEN-ANTIBODY REACTIONS KOYAMA SHOZO (JP) 2002-02-12 US disclosed
EP-0780122-A1 DEPRESSANT OF FUNCTIONS DEVELOPED BY MOLECULE Koyama, Shozo (JP) 1997-06-25 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 (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-20070066654-A1 Inhibitory or blocking agents of molecular generating and/or inducing functions CD47, SERPINB6, CD74 POLB 3064/4885CYP19A1 2046/4885NR3C1 2665/4885
US-20020165206-A1 Inhibitory or blocking agents of molecular generating and/or inducing functions CD69, TFPI, SERPINE1 POLB 97/4885CYP19A1 293/4885NR3C1 3072/4885
US-20040224926-A1 Inhibitory or blocking agents of molecular generating and/or inducing functions CD47, MCL1, CD74 POLB 2724/4885CYP19A1 1601/4885NR3C1 1803/4885
US-20080200558-A1 Inhibitory or blocking agents of molecular generating and/or/ inducing functions CD47, MCL1, BAK1 POLB 2907/4885CYP19A1 2309/4885NR3C1 2752/4885

“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.