SCHEMBL18140754

SCHEMBL18140754

CCCCCCCCC#CS(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 5/20 0.48
HMGCR P04035 3/20 0.48
RECQL P46063 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
EPHX2 P34913 4/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
MCL1 Q07820 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
PPARA Q07869 2/20 0.38

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
SCHEMBL18141661 1.00 PTPN7 (0.48) PTPN7HMGCRRECQLTDP1EPHX2
SCHEMBL8617504 1.00 PTPN7 (0.48) PTPN7HMGCRRECQLTDP1EPHX2
SCHEMBL18141348 1.00 PTPN7 (0.48) PTPN7HMGCRRECQLTDP1EPHX2
SCHEMBL18140497 1.00 PTPN7 (0.48) PTPN7HMGCRRECQLTDP1EPHX2
SCHEMBL18139924 1.00 PTPN7 (0.48) PTPN7HMGCRRECQLTDP1EPHX2
SCHEMBL1109987 0.91 HMGCR (0.39) PTPN7HMGCRRECQLTDP1EPHX2
SCHEMBL6728251 0.81
SCHEMBL11317893 0.79 PTPN7 (0.43) PTPN7HMGCRRECQLTDP1EPHX2
SCHEMBL10994306 0.77 PTPN7 (0.52) PTPN7HMGCRRECQLTDP1EPHX2
SCHEMBL22036827 0.75 PTPN7 (0.39) PTPN7HMGCRRECQLTDP1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180163056-A1 HYDROPHILIC CURABLE COMPOSITIONS MITSUI CHEMICALS, INC. (JP) 2018-06-14 US disclosed
US-20170209345-A1 DENTAL PROSTHESIS MITSUI CHEMICALS, INC. (JP) 2017-07-27 US disclosed
EP-3081578-A1 COMPOSITION FOR HYDROPHILIC CURED PRODUCT Mitsui Chemicals, Inc. (JP) 2016-10-19 EP 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-20170209345-A1 DENTAL PROSTHESIS CAD, OR10J3, PSMA3 PTPN7 4023/4885HMGCR 2520/4885RECQL 2877/4885

“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.