SCHEMBL16595423

SCHEMBL16595423

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.58
▸ CES1 P23141 1/20 0.58
▸ PTPRC P08575 4/20 0.50
▸ PTPN1 P18031 4/20 0.50
▸ PTPN2 P17706 1/20 0.50
▸ PTPRF P10586 1/20 0.49
▸ CPT1B Q92523 1/20 0.48
▸ PARP10 Q53GL7 3/20 0.47
▸ PARP15 Q460N3 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ PARP14 Q460N5 1/20 0.47
▸ PARP16 Q8N5Y8 1/20 0.47
▸ PARP11 Q9NR21 1/20 0.47
▸ PARP4 Q9UKK3 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ NR4A2 P43354 1/20 0.46
▸ BCL2L1 Q07817 2/20 0.46

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
SCHEMBL15180835 0.87 CES2 (0.75) CES2CES1PTPRCPTPN1PTPN2
SCHEMBL263831 0.87 CES2 (0.75) CES2CES1PTPRCPTPN1PTPN2
SCHEMBL3315939 0.83 BCL2L1 (0.65) CES2CES1PARP10PARP15ALDH1A1
SCHEMBL4166171 0.83 PARP10 (0.64) CES2CES1PTPRCPTPN1PTPN2
SCHEMBL9041802 0.83 PTPRC (0.59) CES2CES1PTPRCPTPN1PTPN2
SCHEMBL16595386 0.83 AKR1C3 (0.57) CES2CES1PARP10PARP15PARP14
SCHEMBL16595319 0.81 BCL2L1 (0.68) CES2CES1PTPRCPTPN1PTPN2
SCHEMBL3020544 0.81 SRD5A2 (0.59) CES2CES1PARP10PARP15ALDH1A1
SCHEMBL2862520 0.81 SRD5A2 (0.59) CES2CES1PARP10PARP15ALDH1A1
SCHEMBL15448720 0.81 SRD5A2 (0.59) CES2CES1PARP10PARP15ALDH1A1

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 23/4885PTPRC 2741/4885
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 CES2 88/4885CES1 23/4885PTPRC 2741/4885
US-10227323-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 CES2 88/4885CES1 23/4885PTPRC 2741/4885
US-20190263775-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 CES2 88/4885CES1 23/4885PTPRC 2741/4885

“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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