Sugi Predict

Sugi Predict / Compounds / Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL28049038

CC1(C)CC2(CC(C)(C)c3ccc(OS(=O)(=O)C(F)(F)F)cc32)c2ccccc21.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 9/20 0.35
▸ DRD3 P35462 9/20 0.35
▸ CHRM1 P11229 4/20 0.35
▸ DRD4 P21917 4/20 0.35
▸ PDK2 Q15119 3/20 0.34
▸ RXRA P19793 1/20 0.34
▸ RXRB P28702 1/20 0.34
▸ RXRG P48443 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34
▸ HTR1D P28221 1/20 0.34
▸ DRD1 P21728 1/20 0.33
▸ DRD5 P21918 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
SCHEMBL2455365 0.90 HTR1D (0.39) DRD2DRD3CHRM1DRD4RXRA
SCHEMBL15280722 0.84 HTR1D (0.36) DRD2DRD3CHRM1DRD4RXRA
SCHEMBL13712348 0.74 PDK2 (0.42) DRD2DRD3DRD4PDK2DRD1
SCHEMBL18656390 0.68 RXRA (0.33) RXRA
SCHEMBL16021623 0.68 RXRA (0.33) RXRA
SCHEMBL14515032 0.68 EHMT2 (0.41) DRD2DRD3RXRARXRBRXRG
SCHEMBL13750412 0.68 ALOX5AP (0.51) DRD2DRD3PDK2HSD11B1
SCHEMBL29548964 0.67 HTR2A (0.35) PDK2
SCHEMBL5694129 0.67 HTR2A (0.35) PDK2
SCHEMBL18415542 0.67 MAPT (0.39) PDK2

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
CN-105209506-A Amino-containing polymeric material with rigid and contorted divinyl crosslinker 3M INNOVATIVE PROPERTIES CO 2015-12-30 — — CN disclosed