SCHEMBL21135984

SCHEMBL21135984

O=C(C1CCCCC1)C(F)(CC1CCCCC1)S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.36
HDAC6 Q9UBN7 3/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
MLYCD O95822 1/20 0.33
GRM2 Q14416 1/20 0.33
GRM3 Q14832 1/20 0.33
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HPGD P15428 1/20 0.31
MMP1 P03956 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 1/20 0.30
ADAM17 P78536 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
SCHEMBL21136396 0.81 NAAA (0.36) HDAC6CES2CES1
SCHEMBL21135976 0.81 HDAC6 (0.34) EPHX1HDAC6MLYCDGRM2GRM3
SCHEMBL21135980 0.80 HDAC6 (0.33) HDAC6MLYCDGRM2GRM3HDAC3
SCHEMBL21135974 0.79 MMP1 (0.40) EPHX1HDAC6MLYCDGRM2GRM3
SCHEMBL21136390 0.79 CES2 (0.32) CES2CES1
SCHEMBL21136388 0.79 NAAA (0.37) EPHX1CES2CES1
SCHEMBL21135757 0.78 MMP1 (0.33) HDAC6MLYCDGRM2GRM3HDAC3
SCHEMBL21135740 0.78 HDAC6 (0.32) HDAC6MLYCDGRM2GRM3MMP1
SCHEMBL21135920 0.76 EPHX1 (0.35) EPHX1HDAC6MLYCDGRM2GRM3
SCHEMBL21135699 0.76 SMN1; SMN2 (0.38) HPGDMMP1MMP13

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 EPHX1 139/4885HDAC6 2911/4885CES2 1542/4885

“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.