SCHEMBL16595406

SCHEMBL16595406

COC(=O)C(=O)c1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 2/20 0.52
▸ CES1 P23141 2/20 0.52
▸ HTT P42858 5/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ HPGD P15428 3/20 0.47
▸ TSHR P16473 1/20 0.47
▸ MAPT P10636 5/20 0.47
▸ RAB9A P51151 4/20 0.47
▸ CYP3A4 P08684 1/20 0.46
▸ MAPK14 Q16539 1/20 0.46
▸ PARP10 Q53GL7 2/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ BCL2L1 Q07817 1/20 0.43

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
SCHEMBL1943728 0.91 HPGD (0.56) CES2CES1HTTSMN1; SMN2HPGD
SCHEMBL836180 0.91 CES2 (0.62) CES2CES1HTTSMN1; SMN2HPGD
SCHEMBL9042618 0.85 MAPT (0.57) CES2CES1SMN1; SMN2MAPTRAB9A
SCHEMBL13531604 0.84 CES2 (0.56) CES2CES1HTTSMN1; SMN2HPGD
SCHEMBL12934598 0.84 HPGD (0.53) CES2CES1HTTSMN1; SMN2HPGD
SCHEMBL22407070 0.82 HPGD (0.53) CES2CES1HTTSMN1; SMN2HPGD
SCHEMBL21288599 0.81 KMT2A (0.64) HTTSMN1; SMN2HPGDTSHRMAPT
SCHEMBL16595423 0.79 CES2 (0.58) CES2CES1HPGDMAPTRAB9A
SCHEMBL2122107 0.79 CES2 (0.75) CES2CES1SMN1; SMN2MAPTRAB9A
SCHEMBL9044236 0.78 MAOB (0.49) SMN1; SMN2MAPTPARP10ALDH1A1LMNA

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 CES2 88/4885CES1 23/4885HTT 1455/4885
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 CES2 88/4885CES1 23/4885HTT 1455/4885
US-10227323-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 CES2 88/4885CES1 23/4885HTT 1455/4885
US-20190263775-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 CES2 88/4885CES1 23/4885HTT 1455/4885

“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.

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