SCHEMBL20325622

SCHEMBL20325622

NC(C(=O)O)C(F)(F)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.42
PRCP P42785 1/20 0.40
PPARG P37231 4/20 0.40
PPARA Q07869 1/20 0.40
MIF P14174 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
KDM1A O60341 1/20 0.39
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
MAP4K4 O95819 1/20 0.37
MEN1 O00255 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL20325890 0.95 KIF11 (0.45) KIF11PPARGPPARAMIFGRIN2D
SCHEMBL20325602 0.86 PPARG (0.46) KIF11PPARGPPARAGRIN2DGRIN3B
SCHEMBL13205248 0.80 KIF11 (0.47) KIF11PPARGPPARA
SCHEMBL21501276 0.79 MEN1 (0.35) KIF11PRCPGRIN2DGRIN3BGRIN1
SCHEMBL21501196 0.79 EGLN1 (0.41) PRCPMAP4K4
SCHEMBL20325611 0.79 DPP7 (0.45) MEN1KMT2A
SCHEMBL188034 0.79 KCNN4 (0.47) KIF11MEN1KMT2A
SCHEMBL188035 0.79 KCNN4 (0.47) KIF11MEN1KMT2A
SCHEMBL4394579 0.78 KIF11 (0.46) KIF11CYP2D6KMT2A
SCHEMBL4403169 0.78 KIF11 (0.46) KIF11CYP2D6KMT2A

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-20190322676-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARM INC (US) 2019-10-24 US disclosed
WO-2018118838-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2018-06-28 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 (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-20190322676-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE UGCG, MAN2B1, GBA1 KIF11 1926/4885PRCP 201/4885PPARG 856/4885

“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.