Sugi Predict

Sugi Predict / Compounds / SCHEMBL92831

SCHEMBL92831

SCHEMBL92831

CC(C)(C)C(=O)NS(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.43
▸ CA2 P00918 4/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CA1 P00915 3/20 0.35
▸ CA7 P43166 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ CA14 Q9ULX7 2/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA4 P22748 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ PTK2B Q14289 1/20 0.31

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
SCHEMBL13543139 0.85 PPARA (0.39) PPARACA2ALDH1A1MAPTL3MBTL1
SCHEMBL2746444 0.79 PPARA (0.41) PPARACA2CA1CA9CA4
SCHEMBL28621491 0.79 PPARA (0.44) PPARACA2ALDH1A1MAPTL3MBTL1
SCHEMBL30313750 0.79 PPARA (0.41) PPARACA2
SCHEMBL16051165 0.78 ALDH1A1 (0.38) PPARACA2ALDH1A1MAPTL3MBTL1
SCHEMBL13543347 0.77 PPARA (0.40) PPARACA2ALDH1A1
SCHEMBL24178088 0.76 ALDH1A1 (0.36) PPARACA2ALDH1A1MAPTL3MBTL1
SCHEMBL1618683 0.76 CA2 (0.43) PPARACA2ALDH1A1L3MBTL1CA1
SCHEMBL8115457 0.76 CA1 (0.42) CA2ALDH1A1MAPTL3MBTL1CA1
SCHEMBL108139 0.75 PPARA (0.40) PPARACA2CA1CA7CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1221848-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES Bayer Aktiengesellschaft (DE) 2002-07-17 — — EP claimed
WO-2001022819-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-05 — — WO claimed
US-6174839-B1 AS HERBICIDE NIHON BAYER AGROCHEM K.K. (JP) 2001-01-16 — — US claimed
WO-1999052906-A1 SUBSTITUTED OXAZOLYLE AND THIAZOLYL URACIL HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-10-21 — — WO claimed
US-5935907-A HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 1999-08-10 — — US claimed
EP-0869123-A2 Phenylacetylene derivatives NIHON BAYER AGROCHEM K.K. (JP) 1998-10-07 — — EP claimed
US-20240391904-A1 DIHYDROPYRIMIDINE BASED COMPOUND, PREPARATION METHOD THEREFOR AND USE OF THEREOF CHENGDU SHIBEIKANG BIOMEDICAL TECHNOLOGY CO., LTD. (CN) 2024-11-28 — — US disclosed
US-20240287029-A1 SULFONAMIDES, METHOD FOR PREPARATION THEREOF, AND USE THEREOF CHENGDU SHIBEIKANG BIOMEDICAL TECHNOLOGY CO., LTD. (CN) 2024-08-29 — — US disclosed
EP-4410785-A1 DIHYDROPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Chengdu Shibeikang Biomedical Technology Co., Ltd. (CN) 2024-08-07 — — EP disclosed
EP-4410786-A1 SULFONAMIDE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Chengdu Shibeikang Biomedical Technology Co., Ltd. (CN) 2024-08-07 — — EP disclosed
US-12037324-B2 Biarylmethyl heterocycles BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 — — US disclosed
US-11872236-B2 Pharmacological agents for treating ocular diseases CALASIA PHARMACEUTICALS, INC. (US) 2024-01-16 — — US disclosed
US-11840521-B2 Modulators of Mas-related G-protein receptor X4 and related products and methods ESCIENT PHARMACEUTICALS, INC. (US) 2023-12-12 — — US disclosed
US-7494998-B2 Benzisoxazole piperazine compounds and methods of use thereof HYPNION, INC. (US) 2009-02-24 — — US disclosed
US-20080214539-A1 Benzisoxazole Piperidine Compounds and Methods of Use Thereof HYPNION, INC. 2008-09-04 — — US disclosed
US-6841517-B1 Selective herbicides on basis of N-aryl-triazoline(thi)ones BAYER AKTIENGESELLSCHAFT (DE) 2005-01-11 — — US disclosed
EP-1221848-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES Bayer Aktiengesellschaft (DE) 2002-07-17 — — EP disclosed
WO-2002020487-A1 SUBSTITUTED 1-ARYL-PYRIDIN-2-(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2002-03-14 — — WO disclosed
WO-2001022819-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-05 — — WO disclosed
WO-1999052906-A1 SUBSTITUTED OXAZOLYLE AND THIAZOLYL URACIL HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-10-21 — — 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 (6 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-11840521-B2 Modulators of Mas-related G-protein receptor X4 and related products and methods MRGPRX4, MRGPRX1, MRGPRX2 PPARA 1378/4885CA2 1316/4885ALDH1A1 4266/4885
US-20080214539-A1 Benzisoxazole Piperidine Compounds and Methods of Use Thereof GABRA5, GABRE, HCRTR2 PPARA 167/4885CA2 1519/4885ALDH1A1 1099/4885
US-20240287029-A1 SULFONAMIDES, METHOD FOR PREPARATION THEREOF, AND USE THEREOF P2RX3, P2RX5, P2RX2 PPARA 1833/4885CA2 109/4885ALDH1A1 2252/4885
US-11872236-B2 Pharmacological agents for treating ocular diseases CRYAA, CRYAB, TTR PPARA 93/4885CA2 2196/4885ALDH1A1 1822/4885
US-20240391904-A1 DIHYDROPYRIMIDINE BASED COMPOUND, PREPARATION METHOD THEREFOR AND USE OF THEREOF P2RX3, P2RX6, P2RX7 PPARA 1382/4885CA2 1736/4885ALDH1A1 685/4885
US-12037324-B2 Biarylmethyl heterocycles ARRB1, ADRB2, ADRB1 PPARA 376/4885CA2 1330/4885ALDH1A1 919/4885

“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.