SCHEMBL1634310

SCHEMBL1634310

COc1ccc(CS(=O)(=O)CC(=O)O)cc1SP(=O)(OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 2/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
TAS2R14 Q9NYV8 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
CA5A P35218 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
FFAR1 O14842 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
APP P05067 1/20 0.36
CETP P11597 3/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL1636586 0.88 CA5A (0.39) SMN1; SMN2NPC1RAB9ACA5AGAA
SCHEMBL1636268 0.87 CA5A (0.39) SMN1; SMN2CA5ALMNAMAPTGAA
SCHEMBL1634882 0.83 CA5A (0.40) TAS2R14SMN1; SMN2CA5ALMNAMAPT
SCHEMBL1636845 0.81 TAS2R14 (0.46) SMPD1HDAC1HDAC8HDAC6TAS2R14
SCHEMBL1635864 0.80 FOLH1 (0.43) SMPD1HDAC1HDAC8HDAC6SMN1; SMN2
SCHEMBL1634504 0.80 L3MBTL1 (0.47) SMN1; SMN2MAPTGAAPKM
SCHEMBL1635284 0.78 SMPD1 (0.39) SMPD1HDAC1HDAC8HDAC6TAS2R14
SCHEMBL1634824 0.77 PLK1 (0.52) HDAC1HDAC8HDAC6SMN1; SMN2LMNA
SCHEMBL1634932 0.77 NPC1 (0.49) SMPD1HDAC1HDAC8HDAC6SMN1; SMN2
SCHEMBL1634444 0.74 CA5A (0.44) TAS2R14SMN1; SMN2CA5ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1740530-B1 SUBSTITUTED PHENOXY- AND PHENYLTHIO-DERIVATIVES FOR TREATING PROLIFERATIVE DISORDERS UNIV TEMPLE (US) 2016-09-28 EP claimed
US-20080058290-A1 Substituted Phenoxy-and Phenylthio-Derivatives for Treating Proliferative Disorders TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2008-03-06 US claimed
EP-3138832-A1 SUBSTITUTED PHENOXY- AND PHENYLTHIO- DERIVATIVES FOR TREATING PROLIFERATIVE DISORDERS Temple University - Of The Commonwealth System of Higher Education (US) 2017-03-08 EP disclosed
US-7932242-B2 Anticancer agents; radiation and chemical resistance TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2011-04-26 US disclosed
US-20080058290-A1 Substituted Phenoxy-and Phenylthio-Derivatives for Treating Proliferative Disorders TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2008-03-06 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-20080058290-A1 Substituted Phenoxy-and Phenylthio-Derivatives for Treating Proliferative Disorders PCNA, MKI67, TP53 SMPD1 2609/4885HDAC1 525/4885HDAC8 1072/4885

“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.