SCHEMBL4268262

SCHEMBL4268262

C=C1C(=O)C=CC(C)(C)C1OCCCCC

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.34
PPARD Q03181 2/20 0.34
PPARA Q07869 2/20 0.34
GBA1 P04062 1/20 0.33
DNTT P04053 1/20 0.32
POLB P06746 1/20 0.32
POLA1 P09884 1/20 0.32
GSTA2 P09210 2/20 0.31
GSTP1 P09211 2/20 0.31
LMNA P02545 1/20 0.31
GSTM1 P09488 1/20 0.31
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL4273611 0.99 PPARG (0.36) PPARGPPARDPPARAGBA1DNTT
SCHEMBL4269213 0.73 POLB (0.38) DNTTPOLB
SCHEMBL4264692 0.72 NFKB1 (0.33) POLB
SCHEMBL4276971 0.69 GBA1 (0.34) PPARGPPARDPPARAGBA1POLB
SCHEMBL4279220 0.68 GBA1 (0.37) PPARGPPARDPPARAGBA1POLB
SCHEMBL4271643 0.67 PTGS2 (0.34)
SCHEMBL4267338 0.66 CYP19A1 (0.36) PPARGPPARDPPARAGBA1DNTT
SCHEMBL4272133 0.65 DNTT (0.37) PPARGPPARDPPARAGBA1DNTT
SCHEMBL11135814 0.63 MAPT (0.35) DNTTPOLBPOLA1LMNATP53
SCHEMBL28050144 0.63 LMNA (0.36) PPARGGBA1POLBLMNA

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 PPARG 3561/4885PPARD 4073/4885PPARA 3528/4885
US-20020165206-A1 Inhibitory or blocking agents of molecular generating and/or inducing functions CD69, TFPI, SERPINE1 PPARG 2209/4885PPARD 3594/4885PPARA 2799/4885
US-20040224926-A1 Inhibitory or blocking agents of molecular generating and/or inducing functions CD47, MCL1, CD74 PPARG 3228/4885PPARD 3995/4885PPARA 3008/4885
US-20080200558-A1 Inhibitory or blocking agents of molecular generating and/or/ inducing functions CD47, MCL1, BAK1 PPARG 3227/4885PPARD 4027/4885PPARA 3448/4885

“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.