SCHEMBL21135704

SCHEMBL21135704

CC(F)(CC1CCCCC1)S(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
ADAM17 P78536 1/20 0.35
CYP1A2 P05177 1/20 0.33
GRM2 Q14416 1/20 0.33
GRM3 Q14832 1/20 0.33
PDK1 Q15118 1/20 0.33
PDK2 Q15119 1/20 0.33
PDK3 Q15120 1/20 0.33
PDK4 Q16654 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ATM Q13315 1/20 0.32
HPGD P15428 1/20 0.31
MLYCD O95822 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
METAP1 P53582 1/20 0.30

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
SCHEMBL3873460 0.80 GRM2 (0.34) MMP1MMP9MMP13ADAM17CYP1A2
SCHEMBL21136042 0.78 ALDH1A1 (0.33) MMP1MMP9MMP13ADAM17CYP1A2
SCHEMBL3876683 0.78 GRM2 (0.32) GRM2GRM3ALDH1A1ATM
SCHEMBL12307775 0.77 GRM2 (0.33) MMP1MMP9MMP13ADAM17GRM2
SCHEMBL18785291 0.77 GRM2 (0.33) MMP1MMP9MMP13ADAM17GRM2
SCHEMBL21135976 0.77 HDAC6 (0.34) MMP1MMP9MMP13ADAM17CYP1A2
SCHEMBL21135957 0.77 METAP1 (0.31) MMP1MMP9MMP13ADAM17CYP1A2
SCHEMBL21136045 0.77 CYP1A2 (0.34) MMP1MMP9MMP13ADAM17CYP1A2
SCHEMBL5504916 0.77 ADH1B (0.36) MMP1MMP9ALDH1A1ATMMLYCD
SCHEMBL21136015 0.76 GRM2 (0.32) GRM2GRM3HPGD

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-20190196326-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD OF MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2019-06-27 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-20190196326-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD OF MANUFACTURING ELECTRONIC DEVICE RER1, ACTR5, RAD51 MMP1 3169/4885MMP9 1850/4885MMP13 2513/4885

“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.