SCHEMBL2655044

SCHEMBL2655044

CS(=O)(=O)c1ccccc1CC(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
MMP2 P08253 10/20 0.41
MMP12 P39900 10/20 0.41
MMP13 P45452 9/20 0.41
MMP14 P50281 9/20 0.41
MMP9 P14780 9/20 0.41
MMP8 P22894 8/20 0.41
MMP16 P51512 8/20 0.41
MMP1 P03956 7/20 0.41
MMP3 P08254 7/20 0.41
BCAT2 O15382 1/20 0.40
ADAM17 P78536 1/20 0.38
SLC6A2 P23975 1/20 0.38
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37

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
Hydrochloric Acid SCHEMBL6647677 0.98 MEN1 (0.43) MEN1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL28247232 0.84 MMP2 (0.41) CYP1A2CYP3A4CYP2D6CYP2C19KMT2A
SCHEMBL6069328 0.83 MMP2 (0.58) MEN1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL18281576 0.83 TTR (0.43) CYP1A2MMP2MMP12MMP13MMP14
SCHEMBL4749786 0.83 CA1 (0.49) MMP2MMP12MMP13MMP14MMP9
SCHEMBL20565283 0.81 MMP2 (0.41) MMP2MMP12MMP13MMP14MMP9
SCHEMBL11324205 0.81 PTGDR2 (0.45) MMP2MMP12MMP13MMP14MMP9
SCHEMBL23174405 0.79 MEN1 (0.48) MEN1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL10339218 0.77 AKR1B1 (0.46) CYP1A2CYP3A4CYP2D6CYP2C19CA2
SCHEMBL506623 0.76 CYP2D6 (0.45) MEN1CYP1A2CYP3A4CYP2D6CYP2C19

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230321042-A1 COMBINATION THERAPY PFIZER INC. (US) 2023-10-12 US disclosed
EP-4181919-A1 COMBINATION THERAPY Pfizer Inc. (US) 2023-05-24 EP disclosed
WO-2022135365-A1 DISUBSTITUTED CYCLOPENTANE KINASE INHIBITORS ANRUI BIOMEDICAL TECHNOLOGY (GUANGZHOU) CO., LTD. (CN) 2022-06-30 WO disclosed
WO-2022018667-A1 COMBINATION THERAPIES USING CDK2 AND CDC25A INHIBITORS PFIZER INC. (US) 2022-01-27 WO disclosed
WO-2022018596-A1 COMBINATION THERAPY PFIZER INC. (US) 2022-01-27 WO disclosed
EP-2694509-A1 PYRROLO [2, 3 -D]PYRIMIDINE DERIVATIVES AS INHIBITORS OF TROPOMYOSIN- RELATED KINASES Pfizer Limited (GB) 2014-02-12 EP disclosed
WO-2012137089-A1 PYRROLO [2, 3 -D] PYRIMIDINE DERIVATIVES AS INHIBITORS OF TROPOMYOSIN- RELATED KINASES PFIZER LIMITED (GB) 2012-10-11 WO disclosed
EP-1572670-A1 5-SUBSTITUTED-PYRAZINE OR -PYRIDINE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-14 EP disclosed
EP-1448525-A1 NOVEL PIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTORS AstraZeneca AB (SE) 2004-08-25 EP disclosed
WO-2004052869-A1 5-SUBSTITUTED-PYRAZINE OR PYRIDINE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2004-06-24 WO disclosed
WO-2003042178-A1 NOVEL PIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTORS ASTRAZENECA AB (SE) 2003-05-22 WO disclosed
US-6414013-B1 KINASE INHIBITORS; ANTICANCER AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-07-02 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 (1 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-20230321042-A1 COMBINATION THERAPY CDK4, CDK6, CDK2 MEN1 1685/4885CYP1A2 2241/4885CYP3A4 1803/4885

“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.