SCHEMBL16595353

SCHEMBL16595353

CCOC(=O)C(F)(F)c1ccc2cc(Cl)ccc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.48
▸ ABCB11 O95342 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ HTR2A P28223 1/20 0.48
▸ PMP22 Q01453 1/20 0.48
▸ PPARA Q07869 1/20 0.48
▸ ACSS2 Q9NR19 1/20 0.45
▸ ALOX15 P16050 1/20 0.44
▸ MAOB P27338 1/20 0.43
▸ MAPT P10636 4/20 0.42
▸ LMNA P02545 4/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ CRHBP P24387 1/20 0.42
▸ CRHR2 Q13324 1/20 0.42
▸ OPRK1 P41145 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ CNR2 P34972 2/20 0.40
▸ KMT2A Q03164 2/20 0.40

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
SCHEMBL8258321 0.85 TSHR (0.55) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL30914092 0.82 MAPT (0.46) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL1561435 0.82 MAPT (0.46) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL20325604 0.81 HTR2A (0.56) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL30730313 0.81 MAPT (0.53) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL14330650 0.80 CYP1A2 (0.46) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL17420733 0.79 ACSS2 (0.44) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL30628265 0.79 ACSS2 (0.44) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL13199136 0.79 TSHR (0.49) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL4517039 0.79 ACSS2 (0.46) TSHRABCB11CYP1A2CYP3A4HTR2A

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 TSHR 3371/4885ABCB11 730/4885CYP1A2 1700/4885
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 TSHR 3371/4885ABCB11 730/4885CYP1A2 1700/4885
US-10227323-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 TSHR 3371/4885ABCB11 730/4885CYP1A2 1700/4885
US-20190263775-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 TSHR 3371/4885ABCB11 730/4885CYP1A2 1700/4885

“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.

Send feedback