SCHEMBL20780432

SCHEMBL20780432

CC(C)N1CC(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)OC1=O

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CETP P11597 7/20 0.45
HTR2B P41595 2/20 0.40
CHRM2 P08172 1/20 0.40
HTR1A P08908 1/20 0.40
DRD3 P35462 1/20 0.40
TACR1 P25103 9/20 0.37
SMYD2 Q9NRG4 1/20 0.36
NR1I2 O75469 1/20 0.33

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
SCHEMBL20794455 0.92 CETP (0.41) CETPHTR2BCHRM2HTR1ADRD3
SCHEMBL20780485 0.91 CETP (0.40) CETPHTR2BCHRM2HTR1ADRD3
SCHEMBL13950177 0.89 CETP (0.42) CETPHTR2BCHRM2HTR1ADRD3
SCHEMBL20780482 0.88 HTR1A (0.56) CETPHTR2BCHRM2HTR1ADRD3
SCHEMBL20780487 0.87 CETP (0.40) CETPHTR2BCHRM2HTR1ADRD3
SCHEMBL23846735 0.82 CETP (0.42) CETPHTR2BCHRM2HTR1ADRD3
SCHEMBL20794457 0.82 CETP (0.42) CETPHTR2BCHRM2HTR1ADRD3
SCHEMBL20794011 0.75 HTR2B (0.47) HTR2B
SCHEMBL20780486 0.75 HTR2B (0.47) HTR2B
SCHEMBL13837966 0.75 HTR2B (0.47) HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210236442-A1 METHODS FOR DELAYING OCCURRENCE OF NEW-ONSET TYPE 2 DIABETES AND FOR SLOWING PROGRESSION OF AND TREATING TYPE 2 DIABETES DALCOR PHARMA UK LTD., LEATHERHEAD, ZUG BRANCH (CH) 2021-08-05 US disclosed
US-20200222406-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS DALCOR PHARMA UK LTD., STOCKPORT ZUG BRANCH (CH) 2020-07-16 US disclosed
WO-2019043018-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS DALCOR PHARMA UK LTD., STOCKPORT ZUG BRANCH (CH) 2019-03-07 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 (2 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-20210236442-A1 METHODS FOR DELAYING OCCURRENCE OF NEW-ONSET TYPE 2 DIABETES AND FOR SLOWING PROGRESSION OF AND TREATING TYPE 2 DIABETES IAPP, SLC5A2, SLC2A2 CETP 311/4885HTR2B 2275/4885CHRM2 1777/4885
US-20200222406-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS HMGCR, PCSK9, FABP3 CETP 10/4885HTR2B 3170/4885CHRM2 1762/4885

“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.