SCHEMBL891085

SCHEMBL891085

O=C(S)c1ccccc1CCCC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.42
CYSLTR2 Q9NS75 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
SLC16A3 O15427 5/20 0.33
ADRB2 P07550 1/20 0.33
SLC6A5 Q9Y345 1/20 0.32
KMT2A Q03164 1/20 0.32
FAAH O00519 1/20 0.32
CES1 P23141 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
SCHEMBL890735 0.87 FOLH1 (0.40) FOLH1CYSLTR2CYSLTR1ALDH1A1LMNA
SCHEMBL1901916 0.77 FOLH1 (0.46) FOLH1ALDH1A1LMNA
SCHEMBL891262 0.76 FOLH1 (0.39) FOLH1ALDH1A1LMNAADRB2
SCHEMBL2453232 0.76 LIPG (0.51) CYSLTR2CYSLTR1ALDH1A1LMNA
SCHEMBL11570752 0.75 LIPG (0.54) CYSLTR2CYSLTR1ALDH1A1LMNA
SCHEMBL11569404 0.75 LIPG (0.54) CYSLTR2CYSLTR1ALDH1A1LMNA
SCHEMBL28468212 0.75 LIPG (0.54) CYSLTR2CYSLTR1ALDH1A1LMNA
SCHEMBL18519295 0.75 LIPG (0.54) CYSLTR2CYSLTR1ALDH1A1LMNA
SCHEMBL9456049 0.75 LIPG (0.54) CYSLTR2CYSLTR1ALDH1A1LMNA
SCHEMBL9456266 0.75 LIPG (0.54) CYSLTR2CYSLTR1ALDH1A1LMNA

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-8710091-B2 Imidazolidine-2,4-dione derivatives, and use thereof as a cancer drug IPSEN PHARMA S.A.S. (FR) 2014-04-29 US disclosed
US-20120083514-A1 IMIDAZOLIDINE-2,4-DIONE DERIVATIVES, AND USE THEREOF AS A CANCER DRUG IPSEN PHARMA S.A.S. (FR) 2012-04-05 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 (1 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-20120083514-A1 IMIDAZOLIDINE-2,4-DIONE DERIVATIVES, AND USE THEREOF AS A CANCER DRUG MKI67, CCND2, CCND1 FOLH1 4446/4885CYSLTR2 3873/4885CYSLTR1 4117/4885

“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.