SCHEMBL3686733

SCHEMBL3686733

Brc1ccc(CCOCc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
IDO1 P14902 2/20 0.45
CHRM3 P20309 2/20 0.45
NAAA Q02083 1/20 0.45
LTA4H P09960 1/20 0.42
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
HTR2A P28223 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
MAOB P27338 1/20 0.41

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
SCHEMBL4768252 0.92 TSHR (0.61) TSHRTDP1L3MBTL1IDO1CHRM3
SCHEMBL4004770 0.89 L3MBTL1 (0.58) TSHRTDP1L3MBTL1IDO1CHRM3
SCHEMBL1066576 0.88 TSHR (0.67) TSHRTDP1L3MBTL1IDO1NAAA
SCHEMBL13643219 0.87 L3MBTL1 (0.65) TSHRTDP1L3MBTL1IDO1LTA4H
SCHEMBL2658064 0.86 TSHR (0.54) TSHRTDP1L3MBTL1IDO1CHRM3
Hydrochloric Acid SCHEMBL1409425 0.86 TSHR (0.64) TSHRTDP1L3MBTL1IDO1NAAA
Water SCHEMBL28780406 0.86 TSHR (0.64) TSHRTDP1L3MBTL1IDO1NAAA
SCHEMBL2657770 0.86 TSHR (0.71) TSHRTDP1IDO1CHRM3NAAA
SCHEMBL3677409 0.85 TSHR (0.54) TSHRTDP1L3MBTL1IDO1NAAA
SCHEMBL134086 0.83 IDO1 (0.61) TSHRIDO1CHRM3HTR2ATAAR1

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 89 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12527776-B2 Treatment of ciliopathies using inhibitors of glucosylceramide synthase (GCS) GENZYME CORPORATION (US) 2026-01-20 US disclosed
EP-3920912-B1 TREATMENT OF CILIOPATHIES USING INHIBITORS OF GLUCOSYLCERAMIDE SYNTHASE (GCS) GENZYME CORP (US) 2025-06-11 EP disclosed
US-20250026749-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2025-01-23 US disclosed
US-12083115-B2 Methods for treating neurological symptoms associated with lysosomal storage diseases GENZYME CORPORATION (US) 2024-09-10 US disclosed
US-12060349-B2 Glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2024-08-13 US disclosed
EP-4349408-A2 METHODS FOR TREATING PROTEINOPATHIES Genzyme Corporation (US) 2024-04-10 EP disclosed
EP-3267983-B1 METHODS FOR TREATING PROTEINOPATHIES GENZYME CORP (US) 2023-12-20 EP disclosed
EP-4100009-A1 METHODS FOR TREATING NEUROLOGICAL SYMPTOMS ASSOCIATED WITH LYSOSOMAL STORAGE DISEASES Genzyme Corporation (US) 2022-12-14 EP disclosed
EP-4098654-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS Genzyme Corporation (US) 2022-12-07 EP disclosed
CN-115427038-A Methods of treating nervous system symptoms associated with lysosomal storage diseases 建新公司 2022-12-02 CN disclosed
WO-2004037806-A1 N-BENZODIOXOLYL, N-BENZODIOXANYL AND N-BENZODIOXEPINYL ARYLCARBONXAMIDE DERIVATIVES, AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM MERCK PATENT GMBH (DE) 2004-05-06 WO disclosed
US-20040063170-A1 Glucopyranosyloxybenzyl benzene derivatives, medicinal compositions containing the same and intermediates in the production thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2004-04-01 US disclosed
US-20040053855-A1 Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the preparation of the derivatives KISSEI PHARMACEUTICAL CO & LTD. (JP) 2004-03-18 US disclosed
EP-1367060-A1 GLUCOPYRANOSYLOXYBENZYLBENZENE DERIVATIVES AND MEDICINAL USE THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2003-12-03 EP disclosed
EP-1344780-A1 GLUCOPYRANOSYLOXYBENZYL BENZENE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES IN THE PRODUCTION THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2003-09-17 EP disclosed
CN-1418219-A Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the prepararation of the derivatives KISSEI PHARMACEUTICAL (JP) 2003-05-14 CN disclosed
EP-1270584-A1 GLUCOPYRANOSYLOXY BENZYLBENZENE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES FOR THE PREPARATION OF THE DERIVATIVES Kissei Pharmaceutical Co., Ltd. (JP) 2003-01-02 EP disclosed
EP-0666262-B1 Optically active compound, liquid crystal containing the same, liquid crystal device and display method using the same CANON KK (JP) 2000-08-30 EP disclosed
US-5849217-A Optically active compound, liquid crystal composition containing the same, liquid crystal device using the same, liquid crystal apparatus and display method CANON KABUSHIKI KAISHA (JP) 1998-12-15 US disclosed
EP-0666262-A1 Optically active compound, liquid crystal containing the same, liquid crystal device and display method using the same CANON KABUSHIKI KAISHA (JP) 1995-08-09 EP 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 (5 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-20040053855-A1 Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the preparation of the derivatives SLC5A2, SLC5A1, SLC2A2 TSHR 3490/4885TDP1 4715/4885L3MBTL1 4015/4885
US-12527776-B2 Treatment of ciliopathies using inhibitors of glucosylceramide synthase (GCS) GBA1, GBA2, GALC TSHR 835/4885TDP1 1253/4885L3MBTL1 275/4885
US-12083115-B2 Methods for treating neurological symptoms associated with lysosomal storage diseases GBA1, GBA2, CLN6 TSHR 4196/4885TDP1 807/4885L3MBTL1 493/4885
US-12060349-B2 Glucosylceramide synthase inhibitors GBA1, GBA2, GALC TSHR 2547/4885TDP1 1957/4885L3MBTL1 3424/4885
US-20250026749-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA TSHR 2412/4885TDP1 2339/4885L3MBTL1 1688/4885

“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.