SCHEMBL6103258

SCHEMBL6103258

CC1(C)OC(=O)c2ccc(OS(=O)(=O)C(F)(F)F)cc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.41
CHRM1 P11229 4/20 0.37
DRD2 P14416 4/20 0.37
DRD3 P35462 4/20 0.37
DRD4 P21917 3/20 0.37
HTR1D P28221 4/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
HTR1A P08908 3/20 0.34
HTR1B P28222 3/20 0.34
TP53 P04637 1/20 0.34
PDK2 Q15119 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
CXCR2 P25025 1/20 0.33

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
SCHEMBL31476394 0.80 CXCR2 (0.42) HSD11B1CHRM1DRD2DRD3DRD4
SCHEMBL6280229 0.80 TP53 (0.41) HSD11B1CHRM1DRD2DRD3DRD4
SCHEMBL6101688 0.77 PGR (0.46) CA1CA2PDK2
SCHEMBL1091438 0.75 PGR (0.45) HSD11B1CHRM1DRD2DRD3DRD4
SCHEMBL19844018 0.75 LMNA (0.44) CHRM1TP53PDK2
SCHEMBL1952664 0.74 HSD11B1 (0.40) HSD11B1CHRM1DRD2DRD3DRD4
SCHEMBL6102848 0.73 CA12 (0.46) CA1
SCHEMBL1807301 0.73 DRD2 (0.39) HSD11B1CHRM1DRD2DRD3DRD4
SCHEMBL10440165 0.72 HSD11B1 (0.41) HSD11B1CHRM1DRD2DRD3DRD4
SCHEMBL17393794 0.72 HSD11B1 (0.41) HSD11B1CHRM1DRD2DRD3DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060004084-A1 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-01-05 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-20060004084-A1 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors CDK2, ERBB2, MAP3K3 HSD11B1 1945/4885CHRM1 3991/4885DRD2 1789/4885

“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.