SCHEMBL21146831

SCHEMBL21146831

CC(C)c1ccc(C(C)(C)c2ccc(C(C)(C)c3ccc(F)cc3)c(F)c2)cc1F

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 3/20 0.40
RORC P51449 1/20 0.33
ESR1 P03372 1/20 0.31
ESR2 Q92731 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
SCHEMBL18559007 0.85 PDE2A (0.36) PDE2ARORC
SCHEMBL20931083 0.78 PDE2A (0.41) PDE2ARORC
SCHEMBL19275147 0.75 PDE2A (0.41) PDE2ARORC
SCHEMBL10267393 0.75 PDE2A (0.50) PDE2A
SCHEMBL19559216 0.74 ESR1 (0.37) PDE2ARORCESR1ESR2
SCHEMBL26137708 0.73 PDE2A (0.53) PDE2A
SCHEMBL26256878 0.73 KCNN4 (0.36)
SCHEMBL15144029 0.72 PDE2A (0.51) PDE2A
SCHEMBL24696003 0.72 PDE2A (0.34) PDE2A
SCHEMBL84521 0.71 PDE2A (0.70) PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10906900-B2 Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-02-02 US disclosed
US-20190211011-A1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2019-07-11 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 (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-10906900-B2 Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases PSEN2, CLN6, MAPT PDE2A 1650/4885RORC 3728/4885ESR1 4264/4885
US-20190211011-A1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES PSEN2, SNCA, MAPT PDE2A 1992/4885RORC 3934/4885ESR1 4331/4885

“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.