SCHEMBL25596649

SCHEMBL25596649

CC1(C)OB(c2cn(S(=O)(=O)c3ccccc3)c3ncc(F)cc23)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.41
HTR6 P50406 6/20 0.37
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
CYP2C19 P33261 1/20 0.32
LIPE Q05469 2/20 0.32
CCNC P24863 1/20 0.32
CDK8 P49336 1/20 0.32
ALDH3A1 P30838 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
PTPN11 Q06124 1/20 0.32
HTR2A P28223 1/20 0.32
HTR7 P34969 1/20 0.32

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
SCHEMBL2126011 0.91 PTPN11 (0.38) BRD4IDO1TDO2CYP2C19ALDH3A1
SCHEMBL14677903 0.87 RAPGEF4 (0.33) BRD4IDO1TDO2LIPE
SCHEMBL1051929 0.85 HTR6 (0.41) BRD4HTR6HTR2AHTR7
SCHEMBL28333115 0.85 DGAT1 (0.33) IDO1TDO2CYP2C19LIPE
SCHEMBL22260778 0.82 PTPN11 (0.37) BRD4HTR6CYP2C19ALDH3A1PTPN11
SCHEMBL1045785 0.82 HTR6 (0.52) BRD4HTR6CYP2C19CCNCCDK8
SCHEMBL30235753 0.82 HTR6 (0.52) BRD4HTR6CYP2C19CCNCCDK8
SCHEMBL14688109 0.82 MEN1 (0.41) BRD4HTR6LIPEPTPN11
SCHEMBL2725102 0.82 PDPK1 (0.46) BRD4HTR6PTPN11
SCHEMBL1487619 0.81 BRD4 (0.43) BRD4HTR6PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240360165-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) MEDIC LIFE SCIENCES, INC. 2024-10-31 US disclosed
EP-4295852-A2 PIPERIDINE DERIVATIVES AS INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) Syros Pharmaceuticals, Inc. (US) 2023-12-27 EP disclosed
EP-3484871-B1 PIPERIDINE DERIVATIVES AS INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS INC (US) 2023-06-07 EP disclosed
EP-3484871-B1 PIPERIDINE DERIVATIVES AS INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS INC (US) 2023-06-07 EP disclosed
US-20230062491-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) MEDIC LIFE SCIENCES, INC. 2023-03-02 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 (2 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-20240360165-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 BRD4 517/4885HTR6 3675/4885IDO1 1051/4885
US-20230062491-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 BRD4 517/4885HTR6 3675/4885IDO1 1051/4885

“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.