SCHEMBL16595348

SCHEMBL16595348

O=C(O)/C(CCc1ccc2ccccc2c1)=N/O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.58
PDPK1 O15530 1/20 0.54
FFAR1 O14842 1/20 0.49
CTBP2 P56545 2/20 0.49
HDAC1 Q13547 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HCAR2 Q8TDS4 3/20 0.47
SLC13A5 Q86YT5 1/20 0.47
SOX18 P35713 1/20 0.46
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
FFAR4 Q5NUL3 1/20 0.42

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
SCHEMBL17996628 1.00 CYP1A2 (0.58) CYP1A2PDPK1FFAR1CTBP2HDAC1
SCHEMBL16595683 0.85 CTBP2 (0.54) CYP1A2PDPK1FFAR1CTBP2FFAR4
SCHEMBL7060418 0.82 CYP1A2 (0.49) CYP1A2PDPK1FFAR1HDAC1HDAC8
SCHEMBL7060415 0.82 CYP1A2 (0.49) CYP1A2PDPK1FFAR1HDAC1HDAC8
SCHEMBL16595881 0.82 CYP1A2 (0.49) CYP1A2PDPK1FFAR1HDAC1HDAC8
SCHEMBL7061745 0.82 CYP1A2 (0.52) CYP1A2PDPK1FFAR1HDAC1HDAC8
SCHEMBL7061744 0.82 CYP1A2 (0.52) CYP1A2PDPK1FFAR1HDAC1HDAC8
SCHEMBL7061771 0.80 CYP1A2 (0.47) CYP1A2PDPK1FFAR1HDAC1HDAC8
SCHEMBL7061768 0.80 CYP1A2 (0.47) CYP1A2PDPK1FFAR1HDAC1HDAC8
SCHEMBL16595075 0.80 CYP1A2 (0.65) CYP1A2PDPK1FFAR1HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3912977-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BioMarin Pharmaceutical Inc. (US) 2021-11-24 EP disclosed
EP-3046920-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARM INC (US) 2021-08-04 EP disclosed
US-10927092-B2 Glucosylceramide synthase inhibitors for the treatment of diseases BIOMARIN PHARM INC (US) 2021-02-23 US disclosed
US-20190263775-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARM INC (US) 2019-08-29 US disclosed
US-10227323-B2 Glucosylceramide synthase inhibitors for the treatment of diseases BIOMARIN PHARMACEUTICAL INC. (US) 2019-03-12 US disclosed
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2016-08-11 US disclosed
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2016-08-11 US disclosed
WO-2015042397-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2015-03-26 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 (4 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-10927092-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 CYP1A2 1700/4885PDPK1 1683/4885FFAR1 1502/4885
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 CYP1A2 1700/4885PDPK1 1683/4885FFAR1 1502/4885
US-10227323-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 CYP1A2 1700/4885PDPK1 1683/4885FFAR1 1502/4885
US-20190263775-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 CYP1A2 1700/4885PDPK1 1683/4885FFAR1 1502/4885

“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.