SCHEMBL29750

SCHEMBL29750

[O]S(=O)(=O)c1ccccc1Br

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.65
CA2 P00918 5/20 0.65
CA6 P23280 3/20 0.65
CA4 P22748 2/20 0.65
PLCG1 P19174 1/20 0.60
MAPT P10636 1/20 0.46
AKR1B1 P15121 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
RECQL P46063 1/20 0.42
LOX P28300 1/20 0.42
CA9 Q16790 4/20 0.41
CA5A P35218 3/20 0.41
CA12 O43570 2/20 0.41
CA7 P43166 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
CYP2C9 P11712 1/20 0.41
CA14 Q9ULX7 1/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 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
SCHEMBL5818974 0.81 CA2 (0.50) CA1CA2CA6CA4PLCG1
SCHEMBL38660050 0.81 CA1 (0.68) CA1CA2CA6CA4PLCG1
SCHEMBL2475835 0.81 CA1 (0.68) CA1CA2CA6CA4PLCG1
SCHEMBL8686749 0.79 CA1 (0.65) CA1CA2CA6CA4PLCG1
SCHEMBL30630011 0.79 CA2 (1.00) CA1CA2CA6CA4PLCG1
SCHEMBL344271 0.79 CA2 (1.00) CA1CA2CA6CA4PLCG1
SCHEMBL122413 0.77 CA1 (0.62) CA1CA2CA6CA4PLCG1
SCHEMBL10415325 0.77 CA2 (0.95) CA1CA2CA6CA4PLCG1
SCHEMBL8071 0.77 CA1 (0.62) CA1CA2CA6CA4PLCG1
SCHEMBL1542687 0.77 CA1 (0.62) CA1CA2CA6CA4PLCG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114605310-B Synthesis method of aza five-membered ring and three-membered ring carboxylic ester derivative and salt thereof 都创(上海)医药科技股份有限公司 2024-05-07 CN claimed
US-20220227773-A1 FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2022-07-21 US claimed
CN-112010859-B Fused ring compound, preparation method and application thereof 中国科学院上海药物研究所 2022-07-19 CN claimed
WO-2020239073-A1 FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海药物研究所 2020-12-03 WO claimed
CN-112010859-A Fused ring compound, preparation method and application thereof 中国科学院上海药物研究所 2020-12-01 CN claimed
EP-2361248-B1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE CAR LLC (BM) 2018-09-19 EP claimed
US-20180002367-A1 Phosphorodiamidate Backbone Linkage for Oligonucleotides BIOPHARMA CREDIT PLC [COLLATERAL AGENT] (GB) 2018-01-04 US claimed
WO-2016187028-A1 HETEROARYL COMPOUNDS, SYNTHESIS THEREOF, AND INTERMEDIATES THERETO CELGENE AVILOMICS RESEARCH, INC. (US) 2016-11-24 WO claimed
US-8492390-B2 Synthesis of locked nucleic acid derivatives SANTARIS PHARMA A/S (DK) 2013-07-23 US claimed
US-8084458-B2 Synthesis of locked nucleic acid derivatives SANTARIS PHARMA A/S (DK) 2011-12-27 US claimed
US-20020086884-A1 Anticancer agents based on regulation of protein prenylation ARIZONA BIOMEDICAL RESEARCH COMMISSION 2002-07-04 US claimed
WO-2002034247-A2 ANTICANCER AGENTS BASED ON REGULATION OF PROTEIN PRENYLATION THE ARIZONA DISEASE CONTROL RESEARCH COMMISSION (US) 2002-05-02 WO claimed
JP-3187838-B2 2001-07-16 JP claimed
EP-0737195-A1 NEW GINKGOLIDE DERIVATIVES AND A PROCESS FOR PREPARING THEM SUNKYONG INDUSTRIES CO., LTD. (KR) 1996-10-16 EP claimed
WO-1995018131-A1 NEW GINKGOLIDE DERIVATIVES AND A PROCESS FOR PREPARING THEM SUNKYONG INDUSTRIES CO., LTD. (KR) 1995-07-06 WO claimed
CN-1092776-A 2-(9-Fluorenone base) carbapeneme intermediate MERCK & CO INC (US) 1994-09-28 CN claimed
US-4837307-A [1,1'-biphenyl]compounds having a 2,2'-(alkyl)bridge and a 3-yl(substituted)methyl substituent FMC CORPORATION (US) 1989-06-06 US claimed
US-4680310-A HYPOTENSIVE AGENTS HOFFMANN-LA ROCHE INC. (US) 1987-07-14 US claimed
US-4668792-A Intermediates to insecticidal [1,1'-biphenyl]-3-ylmethyl esters FMC CORPORATION (US) 1987-05-26 US claimed
US-4366316-A FROM OXAZOLINOAZETIDINONE AND ACID SHIONOGI & CO., LTD. (JP) 1982-12-28 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20180002367-A1 Phosphorodiamidate Backbone Linkage for Oligonucleotides RNGTT, NCL, NOP56 CA1 3932/4885CA2 4079/4885CA6 3205/4885
US-20220227773-A1 FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SLC18A2, SLC6A3, SLC18A3 CA1 3998/4885CA2 4356/4885CA6 4755/4885
US-20020086884-A1 Anticancer agents based on regulation of protein prenylation ARHGDIB, ARHGDIA, RHOA CA1 4208/4885CA2 4143/4885CA6 4033/4885

“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.