SCHEMBL3768469

SCHEMBL3768469

O=C(OC1CCCCC1)C(F)(F)S(=O)(=O)OS(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 6/20 0.40
CYP2D6 P10635 2/20 0.40
CYP3A4 P08684 1/20 0.40
FABP7 O15540 1/20 0.39
FABP5 Q01469 1/20 0.39
CYP19A1 P11511 1/20 0.39
NR1I2 O75469 1/20 0.38
CHRM2 P08172 6/20 0.38
LMNA P02545 1/20 0.38
CYP2C19 P33261 1/20 0.38
SLC6A4 P31645 1/20 0.38
KCNH2 Q12809 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
SLC22A1 O15245 1/20 0.38
ENPP3 O14638 2/20 0.37
ENPP1 P22413 2/20 0.37
ENPP2 Q13822 1/20 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
SCHEMBL245133 0.76 GAA (0.47) CYP2D6CYP3A4LMNACYP2C19ALDH1A1
SCHEMBL1634800 0.76 HSD11B1 (0.39) CYP2D6CYP3A4CYP2C19ALDH1A1CYP1A2
SCHEMBL26191701 0.75 ALDH1A1 (0.39) CHRM3ALDH1A1
SCHEMBL26190612 0.74 CYP19A1 (0.41) CYP19A1CYP2C19
SCHEMBL3768465 0.73 FABP7 (0.38) CHRM3CYP2D6FABP7FABP5CYP19A1
SCHEMBL547233 0.73 KMT2A (0.36) CYP2D6CYP3A4CYP2C19ALDH1A1CYP1A2
SCHEMBL16566543 0.72 CYP19A1 (0.40) CYP19A1ALDH1A1ENPP3ENPP1ENPP2
SCHEMBL3756015 0.72 MEN1 (0.44) CYP2C19ALDH1A1ENPP3ENPP1ENPP2
SCHEMBL12275613 0.72 MMP8 (0.41) NR1I2KCNH2ALDH1A1
SCHEMBL449882 0.72 LMNA (0.44) LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283106-B2 Sulfonic acid salt and derivative thereof, photoacid generator agent, and resist material and pattern formation method using the photoacid generator agent CENTRAL GLASS COMPANY, LIMITED (JP) 2012-10-09 US disclosed
US-20100304303-A1 Novel Sulfonic Acid Salt and Derivative Thereof, Photoacid Generator Agent, and Resist Material and Pattern Formation Method Using the Photoacid Generator Agent CENTRAL GLASS COMPANY, LIMITED (JP) 2010-12-02 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-20100304303-A1 Novel Sulfonic Acid Salt and Derivative Thereof, Photoacid Generator Agent, and Resist Material and Pattern Formation Method Using the Photoacid Generator Agent ARF1, ARF5, ARF6 CHRM3 4518/4885CYP2D6 2543/4885CYP3A4 3000/4885

“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.