SCHEMBL891262

SCHEMBL891262

O=C(S)c1ccccc1CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.39
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
ADRB2 P07550 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
SCHEMBL890735 0.80 FOLH1 (0.40) FOLH1ALDH1A1LMNAADRB2
SCHEMBL3729369 0.77 FOLH1 (0.33) FOLH1ALDH1A1LMNA
SCHEMBL891085 0.76 FOLH1 (0.42) FOLH1ALDH1A1LMNAADRB2
SCHEMBL3725551 0.76 FOLH1 (0.33) FOLH1
SCHEMBL1900362 0.70 FOLH1 (0.48) FOLH1ALDH1A1LMNAADRB2
SCHEMBL25513626 0.69 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1996152 0.68 ALDH1A1 (0.49) ALDH1A1LMNA
SCHEMBL25513622 0.68 ALDH1A1 (0.32) ALDH1A1
SCHEMBL6536333 0.68 HSD11B1 (0.37)
SCHEMBL25513619 0.68 ALDH1A1 (0.32) ALDH1A1

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 4446/4885ALDH1A1 759/4885LMNA 2812/4885

“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.