SCHEMBL9769427

SCHEMBL9769427

O=C(O)CN1C(=O)c2ccccc2S1(=O)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA12 O43570 10/20 1.00
CA9 Q16790 9/20 1.00
CA2 P00918 5/20 1.00
RAB9A P51151 7/20 0.75
NPC1 O15118 6/20 0.75
LMNA P02545 1/20 0.69
CYP2D6 P10635 1/20 0.69
CYP2C9 P11712 1/20 0.69
POLB P06746 1/20 0.68
GAA P10253 1/20 0.68
HSP90AA1 P07900 2/20 0.63
CA1 P00915 1/20 0.63
KDM4E B2RXH2 1/20 0.63
PAX8 Q06710 1/20 0.63
ELANE P08246 2/20 0.63
ALDH1A1 P00352 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61

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
SCHEMBL11142139 0.86 RAB9A (1.00) CA12CA9CA2RAB9ANPC1
SCHEMBL10908945 0.85 CA12 (1.00) CA12CA9CA2RAB9ANPC1
SCHEMBL13606224 0.83 CA12 (0.76) CA12CA9CA2RAB9ANPC1
SCHEMBL11601021 0.82 NPC1 (1.00) CA12CA9CA2RAB9ANPC1
SCHEMBL9168762 0.82 RAB9A (0.86) CA12CA9CA2RAB9ANPC1
SCHEMBL11711641 0.81 CA12 (0.75) CA12CA9CA2RAB9ANPC1
SCHEMBL11144818 0.81 RAB9A (0.84) CA12CA9CA2RAB9ANPC1
SCHEMBL356403 0.81 CA12 (0.69) CA12CA9CA2RAB9ANPC1
SCHEMBL6611636 0.81 CA12 (0.68) CA12CA9CA2RAB9ANPC1
SCHEMBL23185354 0.80 CA12 (0.78) CA12CA9CA2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4471790-B1 SYSTEM AND METHOD FOR DETERMINING MICROBIOME FROM HOST METABOLOME USING A MACHINE LEARNING MODEL MICROBIOTX HEALTH PRIVATE LTD (IN) 2026-04-01 EP disclosed
CN-119409661-A Method for preparing non-steroidal anti-inflammatory drug intermediate in ester solvent 苏州天马医药集团天吉生物制药有限公司 2025-02-11 CN disclosed
EP-4471790-A1 SYSTEM AND METHOD FOR DETERMINING MICROBIOME FROM HOST METABOLOME USING A MACHINE LEARNING MODEL MicrobioTx Health Private Limited (IN) 2024-12-04 EP disclosed
US-10272081-B2 SHIP1 modulators and methods related thereto AQUINOX PHARMACEUTICALS (CANADA) INC. (CA) 2019-04-30 US disclosed
US-10272081-B2 SHIP1 modulators and methods related thereto AQUINOX PHARMACEUTICALS (CANADA) INC. (CA) 2019-04-30 US disclosed
US-20180360828-A9 SHIP1 MODULATORS AND METHODS RELATED THERETO NEOLEUKIN THERAPEUTICS, INC. 2018-12-20 US disclosed
US-20180161324-A1 SHIP1 MODULATORS AND METHODS RELATED THERETO AQUINOX PHARMACEUTICALS CANADA INC (CA) 2018-06-14 US disclosed
US-20180161324-A1 SHIP1 MODULATORS AND METHODS RELATED THERETO AQUINOX PHARMACEUTICALS CANADA INC (CA) 2018-06-14 US disclosed
US-20180161324-A1 SHIP1 MODULATORS AND METHODS RELATED THERETO AQUINOX PHARMACEUTICALS CANADA INC (CA) 2018-06-14 US disclosed
US-9937167-B2 SHIP1 modulators and methods related thereto AQUINOX PHARMACEUTICALS (CANADA) INC. (CA) 2018-04-10 US disclosed
US-20130102576-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2013-04-25 US disclosed
WO-2013057013-A2 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2013-04-25 WO disclosed
US-20090312377-A1 DERIVATIVES OF BENZO[D]ISOTHIAZOLES AS HISTONES DEACETYLASE INHIBITORS UNIVERSIDAD DE GRANADA (ES) 2009-12-17 US disclosed
US-5051510-A Piperidine derivatives as antihistaminics FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMECEUTI-COS S.A. (FAES) (ES) 1991-09-24 US disclosed
EP-0146102-B1 PROCESS FOR PREPARING BENZOTHIAZINE COMPOUNDS SPA SOCIETA' PRODOTTI ANTIBIOTICI S.p.A. (IT) 1989-03-01 EP disclosed
US-4797483-A Process for obtaining 4-hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine-3-carboxamide 1,1-dioxide INDUSPOL, S.A. (ES) 1989-01-10 US disclosed
US-4599406-A ANHYDRIDING, AMIDATION, ANTIINFLAMMATORY AGENTS SPA-SOCIETA PRODOTTI ANTIBIOTICI SPA (IT) 1986-07-08 US disclosed
EP-0146102-A2 Process for preparing benzothiazine compounds SPA SOCIETA' PRODOTTI ANTIBIOTICI S.p.A. (IT) 1985-06-26 EP disclosed
US-4116964-A 2-[(N-2-pyridylcarbamoyl)methyl]saccharin WARNER-LAMBERT COMPANY (US) 1978-09-26 US disclosed
US-4074048-A Process for the preparation of 4-hydroxy-2H-1,2-benzothiazine-3-carboxamide 1,1-dioxides WARNER-LAMBERT COMPANY (US) 1978-02-14 US 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-20090312377-A1 DERIVATIVES OF BENZO[D]ISOTHIAZOLES AS HISTONES DEACETYLASE INHIBITORS HDAC1, HDAC2, HDAC3 CA12 3053/4885CA9 1485/4885CA2 1512/4885
US-10272081-B2 SHIP1 modulators and methods related thereto PPP1R1B, PPM1A, PPM1D CA12 4880/4885CA9 4861/4885CA2 4795/4885
US-20180360828-A9 SHIP1 MODULATORS AND METHODS RELATED THERETO PPP1R1B, PPM1A, PPM1D CA12 4880/4885CA9 4861/4885CA2 4795/4885
US-20130102576-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS PDE4A, PDE3A, PDE4B CA12 4495/4885CA9 2260/4885CA2 1813/4885
US-20180161324-A1 SHIP1 MODULATORS AND METHODS RELATED THERETO PPP1R1B, PPM1A, PPM1D CA12 4880/4885CA9 4861/4885CA2 4795/4885

“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.