SCHEMBL2951376

SCHEMBL2951376

COC1CCCCC(=O)C1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.42
PDE4B Q07343 10/20 0.42
PDE4C Q08493 10/20 0.42
PDE4D Q08499 10/20 0.42
THRB P10828 1/20 0.41
TRIM24 O15164 2/20 0.38
TRIM33 Q9UPN9 2/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.34
VEGFA P15692 1/20 0.31

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
SCHEMBL3438344 0.93
SCHEMBL9686004 0.86 TRIM24 (0.48) PDE4APDE4BPDE4CPDE4DTHRB
SCHEMBL6524180 0.84
SCHEMBL18415030 0.84
SCHEMBL29219040 0.78 TRIM24 (0.42) PDE4APDE4BPDE4CPDE4DTHRB
SCHEMBL6515441 0.78 PDE4A (0.36) PDE4APDE4BPDE4CPDE4DTHRB
SCHEMBL8299358 0.76 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DTHRB
SCHEMBL7894317 0.75 MAPT (0.41) PDE4APDE4BPDE4CPDE4DTHRB
SCHEMBL14720995 0.74
SCHEMBL24603356 0.74 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108239066-A The synthetic method of pharmaceutical intermediate 3- oxo cycloheptanone condensed ethandiols 成都卡迪夫科技有限公司 2018-07-03 CN claimed
CN-108239066-A The synthetic method of pharmaceutical intermediate 3- oxo cycloheptanone condensed ethandiols 成都卡迪夫科技有限公司 2018-07-03 CN disclosed
WO-2013027001-A1 COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 WO disclosed
US-7754886-B2 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES (US) 2010-07-13 US disclosed
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2009-05-28 US disclosed
US-7504512-B2 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES (US) 2009-03-17 US disclosed
EP-1318978-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2006-02-08 EP disclosed
US-20040192681-A1 N-acylsulfonamide apoptosis promoters ABBVIE INC. 2004-09-30 US disclosed
US-6720338-B2 BCL-X1 INHIBITING COMPOSITIONS AND METHODS OF PROMOTING APOPTOSIS IN A MAMMAL ABBOTT LABORATORIES 2004-04-13 US disclosed
EP-1318978-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS Abbott Laboratories (US) 2003-06-18 EP disclosed
US-20020086887-A1 N-Acylsulfonamide apoptosis promoters ABBVIE INC. 2002-07-04 US disclosed
US-20020055631-A1 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES 2002-05-09 US disclosed
WO-2002024636-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2002-03-28 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 (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-20020086887-A1 N-Acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 PDE4A 2921/4885PDE4B 3268/4885PDE4C 3372/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 PDE4A 3235/4885PDE4B 3404/4885PDE4C 3841/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 PDE4A 2921/4885PDE4B 3268/4885PDE4C 3372/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR PDE4A 3135/4885PDE4B 3133/4885PDE4C 3696/4885

“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.