SCHEMBL4595679

SCHEMBL4595679

CC(C)(N)CNc1ccc(C#N)c(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.49
AR P10275 7/20 0.48
CNR2 P34972 1/20 0.45

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
SCHEMBL3061123 0.88 SLC22A12 (0.51) SLC22A12ARCNR2
SCHEMBL3059987 0.85 SLC22A12 (0.50) SLC22A12ARCNR2
SCHEMBL3289311 0.82 AR (0.52) SLC22A12AR
SCHEMBL18974782 0.82 SLC22A12 (0.53) SLC22A12ARCNR2
SCHEMBL3057215 0.81 AR (0.55) SLC22A12AR
SCHEMBL20702470 0.81 SLC22A12 (0.49) SLC22A12ARCNR2
SCHEMBL14685064 0.79 SLC22A12 (0.50) SLC22A12ARCNR2
SCHEMBL3288072 0.79 SLC22A12 (0.50) SLC22A12ARCNR2
SCHEMBL3289361 0.78 AR (0.52) SLC22A12AR
SCHEMBL3414215 0.78 AR (0.51) SLC22A12AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3089974-B1 NOVEL IMIDAZOLIDINE-2,4-DIONE DERIVATIVES IPSEN PHARMA SAS (FR) 2019-02-20 EP disclosed
CN-105849101-B New imidazolidine -2,4- derovatives 益普生制药股份有限公司 2019-02-19 CN disclosed
US-9975880-B2 Imidazolidine-2,4-dione dervatives IPSEN PHARMA S.A.S. (FR) 2018-05-22 US disclosed
EP-3089974-A1 NOVEL IMIDAZOLIDINE-2,4-DIONE DERIVATIVES IPSEN PHARMA S.A.S. (FR) 2016-11-09 EP disclosed
US-20160318908-A1 NOVEL IMIDAZOLIDINE-2,4-DIONE DERIVATIVES IPSEN PHARMA S.A.S. (FR) 2016-11-03 US disclosed
WO-2015100617-A1 NOVEL IMIDAZOLIDINE-2,4-DIONE DERIVATIVES BEAUFOUR-IPSEN (TIANJIN) PHARMACEUTICAL CO., LTD. (CN) 2015-07-09 WO disclosed
EP-1122242-B1 CYANOPHENYL DERIVATIVES ASTELLAS PHARMA INC (JP) 2008-01-16 EP disclosed
US-20040010037-A1 Cyanophenyl derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. 2004-01-15 US disclosed
US-6673799-B1 INHIBITS BINDING TO ANDROGEN RECEPTOR; ANTIANDROGEN YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2004-01-06 US disclosed
EP-1122242-A1 CYANOPHENYL DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2001-08-08 EP 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-20040010037-A1 Cyanophenyl derivative BPHL, AR, KLK3 SLC22A12 2296/4885AR 2/4885CNR2 815/4885
US-20160318908-A1 NOVEL IMIDAZOLIDINE-2,4-DIONE DERIVATIVES MKI67, CCNI, CDKN1A SLC22A12 2904/4885AR 3424/4885CNR2 4148/4885

“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.