SCHEMBL18719954

SCHEMBL18719954

CC(C)Cc1cc(C(C)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.43
HTR2B P41595 2/20 0.43
HTR2C P28335 1/20 0.43
IDO1 P14902 2/20 0.41
SIGMAR1 Q99720 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
ADRA2C P18825 1/20 0.38
SLC6A4 P31645 1/20 0.38
ADRA1A P35348 1/20 0.38
DRD3 P35462 1/20 0.38
OPRK1 P41145 1/20 0.38
TACR1 P25103 6/20 0.38
HMGCR P04035 1/20 0.36
ALDH1A1 P00352 1/20 0.34
CACNA1F O60840 1/20 0.34
CACNA1D Q01668 1/20 0.34
CACNA1S Q13698 1/20 0.34
CACNA1C Q13936 1/20 0.34
ATM Q13315 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
SCHEMBL5018772 0.92 HTR2A (0.48) HTR2AHTR2BHTR2CIDO1SIGMAR1
SCHEMBL26464609 0.81 IDO1 (0.39) HTR2AHTR2BHTR2CIDO1TACR1
SCHEMBL22861021 0.81 HTR2A (0.43) HTR2AHTR2BHTR2CIDO1SIGMAR1
SCHEMBL13400797 0.81 HTR2A (0.43) HTR2AHTR2BHTR2CIDO1SIGMAR1
SCHEMBL8244696 0.81 HTR2A (0.43) HTR2AHTR2BHTR2CIDO1SIGMAR1
SCHEMBL16956639 0.80 HTR2A (0.40) HTR2AHTR2BHTR2CIDO1SIGMAR1
SCHEMBL6814904 0.79 HTR2A (0.46) HTR2AHTR2BHTR2CIDO1SIGMAR1
SCHEMBL16955182 0.79 HTR2A (0.42) HTR2AHTR2BHTR2CIDO1SIGMAR1
SCHEMBL16960837 0.79 HTR2A (0.42) HTR2AHTR2BHTR2CIDO1SIGMAR1
SCHEMBL13434209 0.79 HTR2A (0.42) HTR2AHTR2BHTR2CIDO1SIGMAR1

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-20170101369-A1 SULFONAMIDE COMPOUNDS AND THEIR USE AS STAT5 INHIBITORS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2017-04-13 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-20170101369-A1 SULFONAMIDE COMPOUNDS AND THEIR USE AS STAT5 INHIBITORS STAT5A, STAT5B, JAK2 HTR2A 4018/4885HTR2B 3418/4885HTR2C 3998/4885

“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.